MCULE-3664047551 |
1 |
C1C[C@]2(C)[C@@]3([H])CC=C4[C@]5([H])CC(C)(C)C[C@@H](C(O)=O)C5CC[C@@]4(C)[C@]3(C)CC[C@@]2([H])C(C)(C)[C@H]1O
|
|
MCULE-5113003290 |
1 |
OC(C1CC2CC(CC=C2)C1)=O
|
|
MCULE-5327458615 |
1 |
CC(C(=O)O)C1C2([H])C(CCC(=C2)C)([H])C(C)CC1
|
|
MCULE-7147126046 |
1 |
C[C@@H](C(=O)O)[C@H]1[C@]2([H])[C@](CCC(=C2)C)([H])[C@H](C)CC1
|
|
MCULE-4504483614 |
1 |
C[C@H]1[C@@H]2CCC(C)=C[C@@H]2[C@H]([C@H](C(O)=O)C)CC1
|
|
MCULE-5025931577 |
1 |
C12CC=C3C4CC(CCC4(CCC3(C)C1(C)CCC1C(C)(C)C(CCC21C)O)C)(C)C(=O)O
|
|
MCULE-9341616847 |
1 |
C1C[C@]2(C)[C@@]3([H])CC=C4[C@]5([H])[C@@H](C)[C@H](C)C[C@@H](C(O)=O)C5CC[C@@]4(C)[C@]3(C)CC[C@@]2([H])C(C)(C)[C@H]1O
|
|
MolPort-046-594-431 |
1 |
CC(C1CCC(C)C2CCC(C)=CC12)C(O)=O
|
|
MolPort-038-941-702 |
1 |
C[C@H]([C@@H]1CC[C@@H](C)[C@@H]2CCC(C)=C[C@H]12)C(O)=O
|
|
MolPort-016-633-333 |
1 |
CC1(C)C[C@H](C2CC[C@]3(C)C(=CC[C@@H]4[C@@]5(C)CC[C@H](O)C(C)(C)[C@@H]5CC[C@@]34C)[C@@H]2C1)C(O)=O
|
|
MolPort-039-338-325 |
1 |
C[C@H]1[C@@H](CC[C@]2(C)CC[C@]3(C)C(=CC[C@@H]4[C@@]5(C)CC[C@H](O)C(C)(C)[C@@H]5CC[C@@]34C)[C@H]12)C(O)=O
|
|
MolPort-046-141-505 |
1 |
OC(=O)C1CC2CC=CC(C2)C1
|
|
MolPort-016-633-342 |
1 |
C[C@@H]1C[C@H](C2CC[C@]3(C)C(=CC[C@@H]4[C@@]5(C)CC[C@H](O)C(C)(C)[C@@H]5CC[C@@]34C)[C@@H]2[C@H]1C)C(O)=O
|
|
MolPort-028-754-126 |
1 |
CC1(C)[C@@H](O)CC[C@@]2(C)[C@H]1CC[C@]1(C)[C@@H]2CC=C2[C@@H]3C[C@@](C)(CC[C@]3(C)CC[C@@]12C)C(O)=O
|
|
MolPort-044-637-537 |
0.97 |
CC(C)=CCCC(C1CCC2(C)C3=CCC4C(C)(C)C(O)CCC4(C)C3CCC12C)C(O)=O
|
|
MolPort-044-723-335 |
0.97 |
CC(C)=CCC[C@@H]([C@@H]1CC[C@]2(C)C3=CC[C@H]4C(C)(C)C(=O)CC[C@]4(C)[C@H]3CC[C@@]12C)C(O)=O
|
|
MolPort-044-727-594 |
0.97 |
CC(C)=CCC[C@@H]([C@@H]1CC[C@]2(C)C3=C(CC[C@@]12C)[C@@]1(C)CCC(=O)C(C)(C)[C@@H]1CC3)C(O)=O
|
|
MolPort-044-637-461 |
0.97 |
CC(C)=CCCC(C1CCC2(C)C3=C(CCC12C)C1(C)CCC(=O)C(C)(C)C1CC3)C(O)=O
|
|
MolPort-044-637-536 |
0.97 |
CC(C)=CCCC(C1CCC2(C)C3=C(CCC12C)C1(C)CCC(O)C(C)(C)C1CC3)C(O)=O
|
|
MolPort-039-339-207 |
0.97 |
CC(C)C(=C)CC[C@H]([C@H]1CC[C@@]2(C)C3=C(CC[C@]12C)[C@@]1(C)CC[C@H](O)C(C)(C)[C@@H]1CC3)C(O)=O
|
|
MolPort-046-153-799 |
0.97 |
CC(C)=CCC[C@H]([C@H]1CC[C@@]2(C)C3=C(CC[C@]12C)[C@@]1(C)CCC(=O)C(C)(C)[C@@H]1CC3)C(O)=O
|
|
MolPort-039-338-736 |
0.97 |
CC(C)=CCC[C@H]([C@H]1CC[C@@]2(C)C3=C(CC[C@]12C)[C@@]1(C)CC[C@H](O)C(C)(C)C1CC3)C(O)=O
|
|
MolPort-035-706-317 |
0.97 |
CC1(C)[C@@H](O)CC[C@@]2(C)[C@H]1CCC1=C2CC[C@@]2(C)[C@@H]3C[C@@](C)(CC[C@]3(C)CC[C@]12C)C(O)=O
|
|
MCULE-6190365385 |
0.97 |
C(O)(CC1(C)C(CC(O)=O)(CC=C2C3CCC(C(C)CCC(C)C(C)C)C3(C)CCC12)[H])=O
|
|
MCULE-4320729921 |
0.97 |
C1CC2(C)C3CCC4(C)C(C(CC/C=C(\C)/C)C(O)=O)CCC4(C)C=3CCC2C(C)(C)C1=O
|
|
MolPort-039-052-704 |
0.95 |
CC1(C)[C@@H]2CC[C@]3(C)[C@H](CC=C4[C@@H]5C[C@@](C)(CC[C@]5(CO)CC[C@@]34C)C(O)=O)[C@@]2(C)CCC1=O
|
|
MolPort-021-804-631 |
0.95 |
CC1(CCCC2(C)C1CCC13CC(CO)C(C1)CC=C23)C(O)=O
|
|
MolPort-001-740-913 |
0.95 |
C[C@@]1(CCC2C(C1)=CCC1[C@]2(C)CCC[C@@]1(C)C(O)=O)C=C
|
|
MolPort-039-338-320 |
0.95 |
C[C@@]1(CC[C@H]2C(C1)=CC[C@@H]1[C@]2(C)CCC[C@@]1(C)C(O)=O)C=C
|
|
MolPort-039-338-737 |
0.94 |
CC(C)=CCC[C@@H](C=O)[C@H]1CC[C@@]2(C)C3=C(CC[C@]12C)[C@@]1(C)CC[C@H](O)C(C)(C)C1CC3
|
|
MolPort-020-005-730 |
0.94 |
C[C@@H]1CC[C@]2(C)CC[C@]3(C)C(=CC[C@@H]4[C@@](C)(CCC(O)=O)[C@@H](CC[C@@]34C)C(C)=C)[C@@H]2[C@H]1C
|
|
MolPort-022-366-503 |
0.94 |
OC(=O)CC1CCC=CC1
|
|
MolPort-046-508-765 |
0.94 |
OC(=O)C[C@H]1CCC=CC1
|
|
MolPort-003-663-637 |
0.94 |
OC(=O)C1CCC\C=C/CC1
|
|
MolPort-039-338-287 |
0.94 |
C[C@@]1(CO)CC[C@]2(C)CC[C@]3(C)C(=CC[C@@H]4[C@@]5(C)CCC(=O)C(C)(C)[C@@H]5CC[C@@]34C)[C@@H]2C1
|
|
MCULE-4980717954 |
0.94 |
C1CC(C)(CC(O)=O)C(C)(CC(=O)O)CC=1
|
|
MCULE-4778256781 |
0.94 |
C(O)(=O)CC[C@]1(C)[C@@]2([H])CC=C3[C@]4([H])[C@@H](C)[C@H](C)CC[C@]4(C)CC[C@@]3(C)[C@]2(C)CC[C@H]1C(C)=C
|
|
MCULE-1670830332 |
0.94 |
C(C(O)=O)C[C@]1(C)[C@@]2([H])CC=C3[C@]4([H])[C@@H](C)[C@H](C)CC[C@]4(C)CC[C@@]3(C)[C@]2(C)CC[C@]1(C(C)=C)[H]
|
|
MCULE-9038165616 |
0.94 |
CC(C(O)=O)CC1C2C=CC(CC2)C1
|
|
MCULE-1202438669 |
0.94 |
C1C=CCCC(C(O)=O)CC1
|
|
MCULE-6641232569 |
0.94 |
CC(C(O)=O)(CC1C2C=CC(CC2)C1)C
|
|
MolPort-021-804-810 |
0.92 |
CC1(CC=C2C(CCC3C(C)(CCCC23C)C(O)=O)C1)C=C
|
|
MCULE-9024921933 |
0.92 |
OC(C(CC1C2C=CC(CC2)C1)=O)=O
|
|
MCULE-2911613762 |
0.92 |
[C@H]1(C[C@H]2C[C@@H]1C=C2)CC(O)=O
|
|
MCULE-3655330509 |
0.92 |
OC(C(O)=O)CC1C2C=CC(CC2)C1
|
|
MCULE-1190191150 |
0.92 |
OC(C1(CC1)CC1C2C=CC(CC2)C1)=O
|
|
MCULE-2546809155 |
0.92 |
CC(C(CC1C2C=CC(CC2)C1)=O)(O)C
|
|
MCULE-5225374056 |
0.92 |
CC(C(CC1C2C=CC(CC2)C1)=O)O
|
|
MolPort-029-215-812 |
0.92 |
OC(=O)CC1CC2CC1C=C2
|
|
MolPort-016-630-900 |
0.92 |
OC(=O)C[C@@H]1C[C@H]2C[C@@H]1C=C2
|
|
MolPort-039-338-445 |
0.92 |
CC1(C)CC[C@]2(C)CC[C@]3(C)C(=CC[C@@H]4[C@@]5(C)CCC(=O)C(C)(C)[C@@H]5[C@H](O)C[C@@]34C)[C@@H]2C1
|
|
MolPort-038-948-469 |
0.91 |
CCC=CC1CCC(CC1)C(O)=O
|
|
MolPort-038-948-537 |
0.91 |
CCCCC=C1CCC(CC(O)=O)CC1
|
|
MCULE-3959902732 |
0.90 |
OC([C@H]1[C@H]2C=C[C@H](CC2)C1)=O
|
|
MCULE-5549502379 |
0.90 |
C12C3CC(C=C3)C1C2C(O)=O
|
|
MCULE-4676598997 |
0.90 |
C12[C@@]3([H])[C@](C)(CC[C@](C)(C(O)=O)C3)CC[C@@]1(C)[C@]1([C@]([H])(C(=O)C=2)[C@@]2(C)CC[C@@H](C(C)(C)[C@@]2(CC1)[H])O)C
|
|
MCULE-2582517969 |
0.90 |
C1C[C@@]2([H])[C@H](C)CC[C@@]([H])(C(C(=O)O)=C)[C@@]2([H])C=C1C
|
|
MCULE-9848650209 |
0.90 |
O[C@H]1CC[C@@]2(C)[C@H](C1(C)C)CC[C@@]1(C)[C@]3(C)CC[C@@]4(C)CC[C@@](C(=O)O)(C)C[C@H]4C3=CC([C@@H]12)=O
|
|
MCULE-9549608104 |
0.90 |
C12C(=O)C=C3C4CC(CCC4(CCC3(C)C1(C)CCC1C(C)(C)C(CCC21C)=O)C)(C)C(=O)O
|
|
MCULE-3741444667 |
0.90 |
C12C3C(C)(CCC(C)(C(O)=O)C3)CCC1(C)C1(C(C(=O)C=2)C2(C)CCC(C(C)(C)C2CC1)O)C
|
|
MCULE-5624348400 |
0.90 |
C1(C(=O)O)CC2C=CC1CC2
|
|
MCULE-9853941800 |
0.90 |
CC1C2CCC(C)=CC2C(C(C(O)=O)=C)CC1
|
|
MolPort-023-220-689 |
0.90 |
C[C@@H]1CC[C@H]([C@H]2C=C(C)CC[C@@H]12)C(=C)C(O)=O
|
|
MolPort-039-052-607 |
0.90 |
C[C@H]1[C@@H](C[C@H](O)[C@]2(C)CC[C@]3(C)C(=CC[C@@H]4[C@@]5(C)CCC(=O)C(C)(C)[C@@H]5CC[C@@]34C)[C@H]12)C(O)=O
|
|
MolPort-039-052-646 |
0.90 |
CC1(C)[C@H](O)CC[C@@]2(C)[C@H]1CC[C@]1(C)[C@@H]2CC=C2[C@@H]3C[C@@](C)(C[C@@H](O)[C@]3(C)CC[C@@]12C)C(O)=O
|
|
MolPort-008-322-980 |
0.90 |
CC1(C)C(O)CCC2(C)C1CCC1(C)C2C(=O)C=C2C3CC(C)(CCC3(C)CCC12C)C(O)=O
|
|
MolPort-000-772-330 |
0.90 |
CC1(C)C(O)CC[C@@]2(C)C1CC[C@]1(C)C2C(=O)C=C2C3C[C@](C)(CC[C@]3(C)CC[C@@]12C)C(O)=O
|
|
MolPort-003-666-072 |
0.90 |
CC1(C)[C@@H](O)CC[C@@]2(C)C1CC[C@]1(C)C2C(=O)C=C2[C@@H]3C[C@](C)(CC[C@]3(C)CC[C@@]12C)C(O)=O
|
|
MolPort-035-706-224 |
0.90 |
CC1=C2C[C@@H](CC[C@@]2(C)CCC1)C(=C)C(O)=O
|
|
MolPort-002-507-130 |
0.90 |
CC1(C)[C@@H](O)CC[C@@]2(C)[C@H]1CC[C@]1(C)[C@@H]2C(=O)C=C2[C@@H]3C[C@](C)(CC[C@]3(C)CC[C@@]12C)C(O)=O
|
|
MolPort-002-893-729 |
0.90 |
OC(=O)C1CC2CCC1C=C2
|
|
MolPort-035-706-326 |
0.90 |
CC1(C)[C@H](O)CC[C@@]2(C)[C@H]1CC[C@]1(C)[C@@H]2CC=C2[C@@H]3C[C@@](C)(C[C@H](O)[C@]3(C)CC[C@@]12C)C(O)=O
|
|
MolPort-046-594-326 |
0.90 |
CC1CCC(C2C=C(C)CCC12)C(=C)C(O)=O
|
|
MolPort-039-242-365 |
0.90 |
OC(=O)[C@@H]1C[C@H]2CC[C@@H]1C=C2
|
|
MolPort-007-980-884 |
0.90 |
CC1(C)C(O)CC[C@@]2(C)C1CC[C@]1(C)C2C(=O)C=C2[C@@H]3C[C@](C)(CC[C@]3(C)CC[C@@]12C)C(O)=O
|
|
MolPort-002-524-552 |
0.90 |
CC1(C)C2CC[C@]3(C)C(C(=O)C=C4[C@@H]5C[C@](C)(CC[C@]5(C)CC[C@@]34C)C(O)=O)[C@@]2(C)CCC1=O
|
|
MolPort-027-835-537 |
0.90 |
CC1(C)[C@@H](O)CC[C@@]2(C)C1CC[C@]1(C)[C@@H]2C(=O)C=C2[C@H]3C[C@](C)(CC[C@]3(C)CC[C@@]12C)C(O)=O
|
|
MolPort-001-742-604 |
0.90 |
CC1(C)[C@@H](O)CC[C@@]2(C)C1CC[C@]1(C)C2C(=O)C=C2[C@H]3C[C@](C)(CC[C@]3(C)CC[C@@]12C)C(O)=O
|
|
MolPort-039-062-015 |
0.90 |
CC1(C)[C@@H](O)CC[C@@]2(C)[C@H]1CC[C@]1(C)[C@@H]2C(=O)C=C2[C@H]3C[C@](C)(CC[C@]3(C)CC[C@@]12C)C(O)=O
|
|
MolPort-039-338-094 |
0.90 |
CC1(C)[C@@H]2CC[C@]3(C)[C@H](CC=C4[C@@H]5C[C@@](C)(C[C@@H](O)[C@]5(C)CC[C@@]34C)C(O)=O)[C@@]2(C)CCC1=O
|
|
MolPort-001-972-569 |
0.90 |
OC(=O)C1C2C1C1CC2C=C1
|
|
MolPort-035-706-502 |
0.90 |
C[C@H]1[C@@H](C[C@H](O)[C@]2(C)CC[C@]3(C)C(=CC[C@@H]4[C@@]5(C)CC[C@@H](O)C(C)(C)[C@@H]5CC[C@@]34C)[C@H]12)C(O)=O
|
|
MolPort-023-220-126 |
0.90 |
CC1(C)[C@@H](O)CC[C@@]2(C)C1CC[C@]1(C)[C@@H]2C(=O)C=C2[C@@H]3C[C@](C)(CC[C@]3(C)CC[C@@]12C)C(O)=O
|
|
MolPort-002-514-284 |
0.89 |
CC(C)C1=C[C@@]23CCC4[C@](C)(CCC[C@@]4(C)C(O)=O)C2CC1[C@@H]1[C@H]3C(=O)CCC1=O
|
|
MolPort-035-706-406 |
0.89 |
CC1(C)[C@H](O)CC[C@]2(C)[C@H]3CC[C@H]4[C@@](C)(CC[C@@H]5[C@]4(C)CC[C@H](O)[C@]5(C)C(O)=O)CC3=CC[C@@H]12
|
|
MolPort-007-980-916 |
0.89 |
CC(C)C1=CC23CCC4[C@](C)(CCC[C@@]4(C)C(O)=O)C2CC1[C@@H]1[C@H]3C(=O)CCC1=O
|
|
MolPort-038-386-024 |
0.89 |
CC1CCC2(C)CCC3(C)C(=CCC4C5(C)CCC(O)C(C)(C5CCC34C)C(O)=O)C2C1C
|
|
MolPort-038-386-525 |
0.89 |
CC1(C)CC[C@]2(C)CC[C@]3(C)C(=CCC4[C@@]5(C)CC[C@@H](O)[C@@](C)([C@@H]5CC[C@@]34C)C(O)=O)[C@@H]2C1
|
|
MolPort-006-126-388 |
0.89 |
CC(C)(O)CCCC1=CCC(CC1)C=O
|
|
MolPort-006-069-138 |
0.89 |
CC1(C)CC[C@]2(C)CC[C@]3(C)C(=CC[C@@H]4[C@@]5(C)CC[C@@H](O)[C@@](C)([C@@H]5CC[C@@]34C)C(O)=O)[C@@H]2C1
|
|
MolPort-006-069-379 |
0.89 |
C[C@@H]1CC[C@]2(C)CC[C@]3(C)C(=CC[C@@H]4[C@@]5(C)CC[C@@H](O)[C@@](C)([C@@H]5CC[C@@]34C)C(O)=O)[C@@H]2[C@H]1C
|
|
MCULE-2451101251 |
0.89 |
C12(C)C(C(C)CC(O)=O)CCC1C1C(CC2O)C2(C)CCC(CC2C=C1)O
|
|
MCULE-5384515579 |
0.89 |
C1C[C@]2(C)[C@@]3([H])CC=C4[C@]5([H])[C@@H](C)[C@H](C)CC[C@]5(C)CC[C@@]4(C)[C@]3(C)CC[C@@]2([H])[C@@](C)(C(=O)O)[C@@H]1O
|
|
MCULE-1283574747 |
0.89 |
C[C@@]12CC[C@@]3([H])[C@@]([C@H](O)CC[C@]3(C)[C@@]1([H])CC=C1[C@]3([H])CC(C)(C)CC[C@]3(C)CC[C@@]21C)(C)C(=O)O
|
|
MCULE-8056155072 |
0.89 |
C1CC2(C)C3CC=C4C5C(C)C(C)CCC5(C)CCC4(C)C3(C)CCC2C(C(=O)O)(C)C1O
|
|
MCULE-5702475533 |
0.89 |
C12(CCC(C1(C)C)(C([H])=C([H])C13CCC(C1(C)C)(C(O)=O)C3)C2)C(O)=O
|
|
MCULE-8629297693 |
0.89 |
C1C[C@@]2(C3CC=C4[C@]5([H])CC(C)(C)CC[C@]5(C)CC[C@]4([C@]3(C)CC[C@@]2([H])[C@](C)([C@@H]1O)C(O)=O)C)C
|
|
MCULE-1144217583 |
0.89 |
C1(C=O)CCC(CCCC(O)(C)C)=CC1
|
|
MCULE-7270634760 |
0.89 |
OC(C1C(CC2CC=CCC2)CC1)=O
|
|
MCULE-6935719222 |
0.89 |
OC(C1C(CC2CC=CCC2)CCC1)=O
|
|
MCULE-7417377682 |
0.89 |
OC(C1(CC1)CC1CC=CCC1)=O
|
|
MCULE-1528374574 |
0.89 |
OC(C1(CCC1)CC1CC=CCC1)=O
|
|
MCULE-6438933973 |
0.89 |
CC(C(CC1CC=CCC1)=O)(O)C
|
|
MCULE-5859140606 |
0.89 |
CC1CC(C(O)=O)(CC2CC=CCC2)C1
|
|
MCULE-8798348917 |
0.89 |
C(CCCCCCC(=O)O)CCCCCC/C=C\CCCCCCCC
|
|
MCULE-7702176615 |
0.89 |
CCCCCCCCC=CCCCCCCCCCCCCCC(=O)O
|
|
MCULE-3248745724 |
0.89 |
C(CCCCCCCC)=CCCCCCCCCCCCC(=O)O
|
|
MCULE-6044533117 |
0.89 |
OC(CCCCCCC/C=C\CCCCCCCC)=O
|
|
MCULE-7592205580 |
0.89 |
C(/CCCCCC(C)CC)=C/CCCCC(O)=O
|
|
MCULE-9547538729 |
0.89 |
CCCCCCCCC=CCCCCCCCC(O)=O
|
|
MCULE-8054022250 |
0.89 |
C(CCCCCCCCC=CCCCCCC)(O)=O
|
|
MCULE-9914820446 |
0.89 |
C(/CCCCCCC(C)C)=C/CCCCC(O)=O
|
|
MCULE-1046270451 |
0.89 |
OC(CCCCCCCC=CCCCCCCCC(=O)O)=O
|
|
MCULE-7761893081 |
0.89 |
C(CCCCCC(=O)O)CC/C=C\CCCCCCCC
|
|
MCULE-8191255112 |
0.89 |
CCCCCCCC/C=C\CCCCCCCCCCCC(=O)O
|
|
MCULE-3046418352 |
0.89 |
CCCCCCCC/C=C/CCCCCCCC(=O)O
|
|
MCULE-5077473579 |
0.89 |
C(CCCCCCC(=O)O)CCCC/C=C\CCCCCC
|
|
MolPort-001-739-604 |
0.89 |
CC(C)CCCCCC\C=C/CCCCC(O)=O
|
|
MolPort-009-019-050 |
0.89 |
CCCCCCCC\C=C/CCCCCC(O)=O
|
|
MolPort-003-925-831 |
0.89 |
CCCCCCCC\C=C\CCCCCCCCCC(O)=O
|
|
MolPort-009-019-234 |
0.89 |
CCCCC\C=C/CCCCCCCCCCCCC(O)=O
|
|
MolPort-028-747-855 |
0.89 |
CCCCCCCCC=CCCCCCCCCCCCC(O)=O
|
|
MolPort-046-763-123 |
0.89 |
CCCC\C=C/CCCCCCCCCC(O)=O
|
|
MolPort-003-959-363 |
0.89 |
CCCCCCCCCCC\C=C/CCCCC(O)=O
|
|
MolPort-009-019-328 |
0.89 |
CCCCC\C=C/CCCCCCC\C=C/CCCC(O)=O
|
|
MolPort-044-727-743 |
0.89 |
CCCC\C=C\CCCCCCCCC(O)=O
|
|
MolPort-001-788-274 |
0.89 |
CCCCCCCC\C=C/CCCCCCCC(O)=O
|
|
MolPort-039-010-546 |
0.89 |
OC(=O)CCCCCCCC=CCCCCCCCC(O)=O
|
|
MolPort-006-169-615 |
0.89 |
CCCCCC\C=C\CCCCCCCC(O)=O
|
|
MolPort-009-019-440 |
0.89 |
CCCCC\C=C/CCCC\C=C/CCCCCCC(O)=O
|
|
MolPort-003-959-881 |
0.89 |
CCCCCC\C=C/CCCCCCCCCC(O)=O
|
|
MolPort-006-112-294 |
0.89 |
CCCCCC\C=C\CCCCCCCCCC(O)=O
|
|
MolPort-044-727-744 |
0.89 |
CCCCCC\C=C\CCCCCCCCC(O)=O
|
|
MolPort-023-332-220 |
0.89 |
OC(=O)CCCCCCC\C=C\CCCCCCCC(O)=O
|
|
MolPort-003-933-468 |
0.89 |
CCCCCCCC\C=C/CCCCCCCCCCCC(O)=O
|
|
MolPort-001-780-043 |
0.89 |
CCCCCCCC\C=C\CCCCCCCCCCCC(O)=O
|
|
MolPort-003-933-186 |
0.89 |
CCCCCCCC\C=C/CCCCCCCCCC(O)=O
|
|
MolPort-001-740-137 |
0.89 |
CCCCCC\C=C/CCCCCCCC(O)=O
|
|
MolPort-044-650-172 |
0.89 |
CCCCCCCCCCCCCC\C=C\CCCC(O)=O
|
|
MolPort-046-426-229 |
0.89 |
CCCCCCCCCCC\C=C/CCCCCCC(O)=O
|
|
MolPort-003-958-711 |
0.89 |
CCCC\C=C/CCCCCCCC(O)=O
|
|
MolPort-046-426-181 |
0.89 |
CCCCCCCCCCC\C=C\CCCCC(O)=O
|
|
MolPort-003-958-761 |
0.89 |
CCCC\C=C\CCCCCCCC(O)=O
|
|
MolPort-035-882-134 |
0.89 |
CCCC\C=C/CCCCCCCCC(O)=O
|
|
MolPort-003-941-733 |
0.89 |
CCCCCC\C=C/CCCCCCCCC(O)=O
|
|
MolPort-003-939-503 |
0.89 |
CCCCCCCC\C=C/CCCCCCCCCCCCCC(O)=O
|
|
MolPort-000-882-023 |
0.89 |
CCCCCCCC\C=C\CCCCCCCC(O)=O
|
|
MolPort-003-933-080 |
0.89 |
CCCCCC\C=C/CCCC(O)=O
|
|
MolPort-021-804-454 |
0.89 |
CCC(C)CCCCC\C=C/CCCCC(O)=O
|
|
MolPort-003-941-268 |
0.89 |
CCCCCC\C=C/CCCCCCCCCCCC(O)=O
|
|
MolPort-003-849-687 |
0.89 |
CCCCCCCCC=CCCCCCCCC(O)=O
|
|
MolPort-003-959-025 |
0.89 |
CCCCCCCC\C=C/CCCCCCCCC(O)=O
|
|
MolPort-028-747-803 |
0.89 |
CCCCCCC=CCCCCCCCC(O)=O
|
|
MCULE-2506870963 |
0.88 |
C12(C)CCCC(C)(C(O)=O)C1CCC1CCC(O)CC2=1
|
|
MCULE-1918074338 |
0.88 |
C(C(=O)O)C[C@]1(C)C2=CC[C@@]3(C(=O)CC[C@@]3(C)[C@]2([H])CC[C@@]1([H])C(=C)C)C
|
|
MCULE-6957829896 |
0.88 |
[C@]12(C)CCC(C(C(O)=O)C1CCC2C(C)CCCC(C)C)[C@@]1(C)CCC(C=C1)=O
|
|
MCULE-2411412323 |
0.88 |
C1C[C@@]2([C@@]([H])([C@@](C(O)=O)(C)C1)CC[C@@]13C2=CC[C@]([H])(C(=C)C1)C3)C
|
|
MCULE-5074709635 |
0.88 |
C1C[C@@]2([C@@]([H])([C@@](C(O)=O)(C)C1)CC[C@@]13C2=CC[C@]([H])(C(O)(CO)C1)C3)C
|
|
MCULE-2705141143 |
0.88 |
[C@@]12(C)[C@@H](C)CCCC1=CC[C@H](C2)C(=C)C(O)=O
|
|
MolPort-001-740-226 |
0.88 |
C[C@]1(CCC[C@]2(C)[C@@H]1CC[C@@]13C[C@H](CC=C21)C(=C)C3)C(O)=O
|
|
MolPort-002-841-841 |
0.88 |
CC(C)CCCC(C)C1CCC2C(C(CC[C@]12C)[C@@]1(C)CCC(=O)C=C1)C(O)=O
|
|
MolPort-035-706-407 |
0.88 |
CC1(C)CC[C@@]2(CC=C3[C@]4(C)CC[C@H]5C(C)(C)[C@@H](O)[C@H](O)C[C@]5(C)[C@H]4CC[C@@]3(C)[C@@H]2C1)C(O)=O
|
|
MolPort-044-562-375 |
0.88 |
CC(C)=CCC[C@H]([C@H]1[C@H](O)C[C@@]2(C)C3=C(CC[C@]12C)[C@@]1(C)CC[C@H](O)C(C)(C)C1CC3)C(O)=O
|
|
MolPort-001-740-301 |
0.88 |
C[C@]1(CCC[C@]2(C)[C@@H]1CC[C@@]13C[C@H](CC=C21)C(O)(CO)C3)C(O)=O
|
|
MolPort-046-790-494 |
0.88 |
C[C@]1(CCC[C@]2(C)[C@@H]1CC[C@@]13C[C@@H](CC=C21)[C@@](O)(CO)C3)C(O)=O
|
|
MolPort-001-742-389 |
0.88 |
C[C@H]1CCCC2=CC[C@H](C[C@]12C)C(=C)C(O)=O
|
|
MolPort-035-706-314 |
0.88 |
CC(=C)[C@@H]1CC[C@@H]2C(=CC[C@]3(C)C(=O)CC[C@@]23C)[C@@]1(C)CCC(O)=O
|
|
MolPort-002-510-407 |
0.87 |
C[C@H](CCC(O)=O)[C@H]1CCC2[C@@H]3CC=C4C[C@H](O)CC[C@]4(C)C3CC[C@]12C
|
|
MolPort-005-944-959 |
0.87 |
CC1(C)C(=O)CCC2C1=CCC1CC(C)(C=C)C(O)CC21C
|
|
MolPort-005-944-708 |
0.87 |
C[C@]12CCC[C@](C)(C1CCC1=CC(=O)CCC21)C(O)=O
|
|
MolPort-001-785-925 |
0.87 |
CC12CCC3C(CC=C4CC(O)CCC34C)C1CCC2C(O)=O
|
|
MolPort-001-742-412 |
0.87 |
CC(CC[C@@]1(C)[C@H](C)CC[C@]2(C)C1CC(=O)C=C2C)CC(O)=O
|
|
MolPort-035-706-450 |
0.87 |
C[C@H]1[C@H](CO)CC[C@@]2(CC[C@]3(C)C(=CC[C@@H]4[C@@]5(C)CC[C@H](O)C(C)(C)[C@@H]5CC[C@@]34C)[C@H]12)C(O)=O
|
|
MolPort-002-509-462 |
0.87 |
C[C@@H]([C@H]1CCC2[C@@H]3CC=C4C[C@@H](O)CC[C@]4(C)C3CC[C@]12C)C(O)=O
|
|
MolPort-001-742-304 |
0.87 |
CC(CCC1(C)C(C)CCC2(C)C1CC(=O)C=C2C)CC(O)=O
|
|
MolPort-046-596-232 |
0.87 |
CC(CCC(O)=O)C1CCC2C3CC=C4CC(O)CC[C@]4(C)C3CC[C@]12C
|
|
MolPort-001-741-118 |
0.87 |
C[C@H](CC[C@H]1C(C)=CC(=O)C2C(C)(C)CCC[C@]12C)CC(O)=O
|
|
MolPort-038-386-656 |
0.87 |
CC1C(CCC(O)=O)C2CCCCC2=CC1=O
|
|
MolPort-002-116-843 |
0.87 |
CC1CC2C3CCC4CC(O)CCC4(C)C3=CCC2(C)C1(O)C(C)=O
|
|
MolPort-035-785-285 |
0.87 |
C[C@H](CCC(O)=O)[C@H]1CC[C@H]2[C@@H]3CC=C4C[C@@H](O)CC[C@]4(C)[C@H]3CC[C@]12C
|
|
MolPort-039-338-398 |
0.87 |
C[C@]12CCC[C@](C)([C@@H]1CCC1=CC(=O)CC[C@H]21)C(O)=O
|
|
MolPort-001-740-352 |
0.87 |
C[C@@H](CC[C@H]1C(C)=CC(=O)C2C(C)(C)CCC[C@]12C)CC(O)=O
|
|
MolPort-001-740-351 |
0.87 |
CC(CCC1=C(C)C(=O)CC2C(C)(C)CCC[C@]12C)CC(O)=O
|
|
MolPort-002-176-718 |
0.87 |
CC(CCC(O)=O)C1CCC2C3CC=C4CC(O)CCC4(C)C3CCC12C
|
|
MolPort-006-394-338 |
0.87 |
C[C@H](CCCC(C)C(O)=O)[C@H]1CC[C@H]2[C@@H]3CC=C4C[C@@H](O)CC[C@]4(C)[C@H]3CC[C@]12C
|
|
MolPort-002-506-868 |
0.87 |
C[C@]12CC[C@H]3[C@@H](CC=C4C[C@@H](O)CC[C@]34C)[C@@H]1CC[C@@H]2C(O)=O
|
|
MolPort-046-596-323 |
0.87 |
CC(C1CCC2C3CC=C4CC(O)CC[C@]4(C)C3CC[C@]12C)C(O)=O
|
|
MCULE-2313378449 |
0.87 |
C(O)(C1CCC2C1(C)CCC1C2CC=C2CC(O)CCC21C)=O
|
|
MCULE-2605863241 |
0.87 |
C1C[C@@]2(C)C(C(C=C([C@@H]2CC[C@H](C)CC(O)=O)C)=O)C(C1)(C)C
|
|
MCULE-4819154807 |
0.87 |
C1C[C@@]2(C)C(CC(C(=C2CCC(C)CC(O)=O)C)=O)C(C1)(C)C
|
|
MCULE-9209606443 |
0.87 |
C1CC2C(CCC(=O)O)C(C)C(=O)C=C2CC1
|
|
MCULE-3141539281 |
0.87 |
C12(C)CCC3C(CC=C4CC(O)CCC34C)C1CCC2C(C)CCC(O)=O
|
|
MCULE-4275950574 |
0.87 |
[C@]12(C)CCC3[C@@]([H])(CC=C4C[C@@H](O)CC[C@]34C)C1CC[C@@H]2[C@H](C)C(O)=O
|
|
MCULE-5773428311 |
0.87 |
C1C[C@]2(C)C3C(CCC2[C@](C)(C(O)=O)C1)=CC(=O)CC3
|
|
MCULE-2653535248 |
0.87 |
C1(CC2C(C(=C1)C)(CCC(C2(CCC(C)CC(=O)O)C)C)C)=O
|
|
MCULE-2671029853 |
0.87 |
[C@@]12([H])CC[C@H]([C@H](C)CCC(=O)O)[C@@]1(C)CC[C@]1([H])[C@@]3(C)CC[C@H](O)CC3=CC[C@@]21[H]
|
|
MCULE-1455068472 |
0.87 |
C1C[C@]2(C)[C@@]3([H])CCC(=O)C=C3CC[C@@]2([H])[C@](C)(C(=O)O)C1
|
|
MCULE-5390747778 |
0.87 |
[C@]12(C)CC[C@]3([C@@]([H])(CC=C4C[C@@H](O)CC[C@]34C)[C@]1([H])CC[C@@H]2C(O)=O)[H]
|
|
MCULE-5059257985 |
0.87 |
[C@@H]1(O)CC2[C@](C)(CC1)[C@]1([H])[C@]([H])([C@@]3([H])[C@@](CC1)(C)[C@@H]([C@H](C)CCC(O)=O)CC3)CC=2
|
|
MCULE-9840181952 |
0.87 |
C1C[C@]2(C)[C@@]3([H])CC[C@](C=C)(C)C=C3CC[C@@]2([H])[C@@](C(=O)O)(C)C1
|
|
MCULE-4428892848 |
0.87 |
C1CCC2(C)C3CCC(C=C)(C)C=C3CCC2C1(C(=O)O)C
|
|
MCULE-8928261768 |
0.87 |
C1C[C@]2(C)[C@@]3([H])CC[C@](C=C)(C)C=C3CC[C@@]2([H])[C@](C(=O)O)(C)C1
|
|
MCULE-5541619791 |
0.87 |
[C@]12(C)CCC[C@@](C)(C(O)=O)[C@]1([H])CCC1=C[C@@](CC[C@]12[H])(C)C=C
|
|
MolPort-008-427-020 |
0.87 |
CC1(CCC2C(CCC3C2(C)CCCC3(C)C(O)=O)=C1)C=C
|
|
MolPort-006-668-475 |
0.87 |
CC1(CCC2C(CC[C@@H]3[C@]2(C)CCC[C@]3(C)C(O)=O)=C1)C=C
|
|
MolPort-046-153-807 |
0.87 |
C[C@]1(CC[C@H]2C(CC[C@@H]3[C@]2(C)CCC[C@]3(C)C(O)=O)=C1)C=C
|
|
MolPort-001-742-404 |
0.87 |
C[C@@]1(CCC2C(CCC3C2(C)CCC[C@@]3(C)C(O)=O)=C1)C=C
|
|
MolPort-035-706-428 |
0.87 |
C[C@@H](C[C@@H](O)[C@H](O)C(C)(C)O)[C@@H]1CC[C@]2(C)C3=CC[C@H]4C(C)(C)C(=O)CC[C@]4(C)[C@H]3CC[C@@]12C
|
|
MolPort-003-873-328 |
0.87 |
C[C@]1(CC[C@H]2C(CC[C@@H]3[C@]2(C)CCC[C@@]3(C)C(O)=O)=C1)C=C
|
|
MolPort-006-111-035 |
0.86 |
[K+].CCCCCCCC\C=C/CCCCCCCC([O-])=O
|
|
MolPort-006-111-036 |
0.86 |
[Na+].CCCCCCCC\C=C/CCCCCCCC([O-])=O
|
|
MolPort-028-962-365 |
0.86 |
CC(O)CO.CCCCCCCC\C=C/CCCCCCCC(O)=O
|
|
MolPort-006-116-655 |
0.86 |
[Bi+3].CCCCCCCC\C=C/CCCCCCCC([O-])=O.CCCCCCCC\C=C/CCCCCCCC([O-])=O.CCCCCCCC\C=C/CCCCCCCC([O-])=O
|
|
MolPort-006-118-208 |
0.86 |
[Na+].CCCCCC\C=C/CCCCCCCC([O-])=O
|
|
MolPort-035-918-587 |
0.86 |
OC(=O)C1CCC=CCC1
|
|
MolPort-044-723-428 |
0.86 |
[Na+].CCCCCCCCC=CCCCCCCCC([O-])=O
|
|
MolPort-044-831-841 |
0.86 |
OC(=O)CC1CCC=CCC1
|
|
MCULE-2735934269 |
0.86 |
OC1(C(CC2CC=CCC2)=O)CCCC1
|
|
MCULE-4188975486 |
0.86 |
O=C(CCCCCCCC=CCCCCCCCC)[O-].[K+]
|
|
MCULE-6767000432 |
0.86 |
C1CCC(C(O)=O)CCC=1
|
|
MCULE-2467601128 |
0.86 |
C1(CCCCCCCCCCCCC(=O)O)C=CCC1
|
|
MCULE-2893862044 |
0.86 |
[Na+].C(CCCCCC([O-])=O)CC=CCCCCCCCC
|
|
MCULE-3222494622 |
0.86 |
C12CCC3C(C3CCC=CCCC1C2C(O)=O)C(O)=O
|
|
MCULE-2611969931 |
0.86 |
[C@@H]1(CCCCCCCCCCCCC(=O)O)C=CCC1
|
|
MCULE-9153738942 |
0.86 |
C(CCCCC=CC(C)C)(O)=O
|
|
MolPort-001-764-454 |
0.86 |
CC(C)\C=C\CCCCC(O)=O
|
|
MolPort-003-698-717 |
0.86 |
CC(C)\C=C/CCCCC(O)=O
|
|
MolPort-035-706-391 |
0.85 |
CC1(C)[C@H](O)CC[C@@]2(C)[C@H]1CC[C@]1(C)[C@@H]2CC=C2[C@@H]3CC(=C)CC[C@@]3(CC[C@@]12C)C(O)=O
|
|
MolPort-007-980-885 |
0.85 |
COC(=O)[C@@]1(C)CC[C@]2(C)CC[C@]3(C)C(=CCC4[C@@]5(C)CCC(O)C(C)(C)C5CC[C@@]34C)[C@@H]2C1
|
|
MolPort-001-742-443 |
0.85 |
CC1=CC(=O)[C@H]2C(C)(C)CCC[C@]2(C)[C@H]1CC[C@@](C)(O)C=C
|
|
MolPort-035-706-307 |
0.85 |
CC(C)[C@H]1CC[C@@H]2[C@]1(C)CC[C@]1(C)C3=C(CC[C@@]21C)[C@@](C)(CC(O)=O)[C@@H](CC3)C(C)(C)C=O
|
|
MolPort-002-525-852 |
0.85 |
C[C@@H]1CC2[C@@H]3CC[C@H]4CC(=O)CC[C@]4(C)C3=CC[C@]2(C)[C@@]1(O)C(=O)CO
|
|
MolPort-001-785-920 |
0.85 |
CC12CCC3C(CCC4=CC(=O)CCC34C)C1CCC2C(O)=O
|
|
MolPort-023-219-645 |
0.85 |
C[C@]12CC[C@H]3[C@@H](CCC4=CC(=O)CC[C@]34C)[C@@H]1CCC2C(O)=O
|
|
MolPort-044-183-250 |
0.85 |
C[C@H](CCCC(C)C(O)=O)[C@H]1CC[C@H]2[C@@H]3CCC4=CC(=O)CC[C@]4(C)[C@H]3CC[C@]12C
|
|
MolPort-005-932-301 |
0.85 |
C[C@]12CC[C@H]3[C@@H](CCC4=CC(=O)CC[C@]34C)[C@@H]1CC[C@@H]2C(O)=O
|
|
MCULE-8392723345 |
0.85 |
C12CC=C3C4CC(CCC4(CCC3(C)C1(C)CCC1C(C)(C)C(CCC21C)O)C)(C)C(=O)OC
|
|
MCULE-9449984869 |
0.85 |
C1CC2(C)C3CCC4(C)C(C(CC/C=C(\C)/C)C(O)=O)CCC4(C)C=3C(=O)CC2C(C)(C)C1=O
|
|
MCULE-2445591436 |
0.85 |
C1C[C@]2([H])[C@](C(=O)O)(C)[C@H](C[C@@H](CC)O)C(C)=C[C@]2([H])CC1
|
|
MCULE-1387376761 |
0.85 |
C12CCC(O)C1(C)CCC1=CC(=O)CCC21
|
|
MCULE-8005965492 |
0.85 |
[C@]12(C)CC=C3[C@@]([H])(CC[C@@]4([H])CC(=O)CC[C@]34C)C1C[C@@H](C)[C@]2(O)C(CO)=O
|
|
MCULE-8879177648 |
0.85 |
OC(C1(CC=CCC1)CC1CC=CC1)=O
|
|
MCULE-9625022025 |
0.85 |
CC1CCC(C(=O)O)(C)CC=1
|
|
MCULE-7510220469 |
0.85 |
C1CC2[C@@](CC[C@H]([C@]2(C)CCC(C)CC(=O)O)C)(C(=C1)CO)C
|
|
MCULE-2847349308 |
0.85 |
[C@@H]1(O)CC2[C@](C)(CC1)[C@]1([H])[C@]([H])([C@@]3([H])[C@@](CC1)(C)[C@@H]([C@H](C)CCC=O)CC3)CC=2
|
|
MCULE-4269813571 |
0.85 |
[C@]12(C)CC[C@]3([C@@]([H])(CC=C4C[C@@H](O)CC[C@]34C)[C@]1([H])CC[C@@H]2C(C)=O)[H]
|
|
MCULE-5064546197 |
0.85 |
[C@H]1(C)[C@H](C)[C@@]2([H])C3=CC[C@@]4([C@@]5(C)CCC(C(C)(C)[C@]5([H])CC[C@@]4(C)[C@]3(C)CC[C@@]2(C(O)=O)CC1)=O)[H]
|
|
MCULE-8045386580 |
0.85 |
C1(=O)C([C@@]2([H])[C@](C)(CC1)[C@]1([H])[C@@]([C@]3(C(=CC1)[C@]1([C@@](CCC(C1)(C)C)(C(O)=O)CC3)[H])C)(C)CC2)(C)C
|
|
MCULE-4006235073 |
0.85 |
C12(C)CCC3C(CC=C4CC(O)CCC34C)C1CCC2C(C)=O
|
|
MCULE-1547137893 |
0.85 |
C12CCC(C(C)CCCC(=O)C)C1(C)CCC1C3(C)CCC(O)CC3=CCC21
|
|
MCULE-5277306782 |
0.85 |
O[C@H]1CC[C@@]2(C)C(C1)=CC[C@@H]1[C@H]2CC[C@]2(C)[C@@H](C(C)=O)CC[C@H]21
|
|
MCULE-7929696567 |
0.85 |
C1C[C@]2(C)C3C(=O)C=C4[C@]5([H])CC(C)(C)CC[C@]5(C)CC[C@@]4(C)[C@]3(C)CCC2C(C)(C)[C@H]1O
|
|
MCULE-6728895797 |
0.85 |
C12(C)CCC3C(CC=C4CC(O)CCC34C)C1CC1CCCCC21C(C)=O
|
|
MCULE-6601751883 |
0.85 |
C1(C)CC(CCC=1C)C(O)=O
|
|
MCULE-3143886740 |
0.85 |
C12(C)CCC3(C(CC(CC3)(C)C)C1=CCC1C2(C)CCC2C1(C)CCC(O)C2(C)C)C(O)=O
|
|
MCULE-9335086572 |
0.85 |
CC1C(C)C2C(C(O)=O)(CCC3(C)C4(C)CCC5C(C)(C)C(=O)CCC5(C)C4CC=C32)CC1
|
|
MCULE-6217200752 |
0.85 |
O=C(O)[C@]12[C@@](C3=CC[C@@]4([C@]5(CCC(=O)C(C)(C)[C@]5([H])CC[C@@]4(C)[C@]3(C)CC1)C)[H])([H])[C@@H](C)[C@H](C)CC2
|
|
MCULE-7088367969 |
0.85 |
[C@@]12(C)CC[C@@]3([C@@]([H])(CC(CC3)(C)C)C1=CC[C@@]1([H])[C@@]2(C)CC[C@@]2([C@]1(C)CC[C@H](O)C2(C)C)[H])C(O)=O
|
|
MCULE-7829183730 |
0.85 |
O=C1C(C(C)C)CC2C1(C)CCC1C2CC=C2CC(O)CCC21C
|
|
MCULE-6888052424 |
0.85 |
C1C[C@]2(C)[C@@]3([H])CC=C4[C@]5([H])CC(C)(C)CC[C@]5(C(=O)O)CC[C@@]4(C)[C@]3(C)CC[C@@]2([H])C(C)(C)[C@H]1O
|
|
MCULE-5111117747 |
0.85 |
C[C@H]1[C@H](C)[C@@]2([H])C3=CC[C@]4([H])[C@@]5(C)CC[C@H](O)C(C)(C)[C@]5([H])CC[C@@]4(C)[C@]3(C)CC[C@@]2(C(O)=O)CC1
|
|
MCULE-6089018925 |
0.85 |
C1C[C@]2(C)[C@@]3([H])CC[C@]4(C)[C@@]([H])(C(C)=O)CC[C@@]4([H])[C@]3([H])CC=C2C[C@H]1O
|
|
MCULE-9672606479 |
0.85 |
[C@]12(C)CCC3[C@@]([H])(CC=C4C[C@@H](O)CC[C@]34C)C1CC[C@@H]2[C@H](C)CCCC(C)=O
|
|
MCULE-2538866374 |
0.85 |
C(C1C(C)CC2C3CC=C4CC(O)CCC4(C)C3CCC21C)(=O)C
|
|
MCULE-9474095410 |
0.85 |
[C@@H]1(O)C([C@@]2([H])[C@](C)(CC1)[C@]1([H])[C@@]([C@]3(C(=CC1)[C@]1([C@@](CC[C@H]([C@@H]1C)C)(C(O)=O)CC3)[H])C)(C)CC2)(C)C
|
|
MCULE-6367656540 |
0.85 |
C12=CCC3(C(C)(CCC4([H])C(C(O)CCC34C)(C)C)C1(C)CCC1(CCC(C)C(C)C21)C(O)=O)[H]
|
|
MCULE-3212175174 |
0.85 |
C1(C)(CCC(=C(C)C1)C)C(O)=O
|
|
MCULE-3629918410 |
0.85 |
O=C(CCC(C)C1CCC2C1(C)CCC1C2CC=C2CC(O)CCC21C)CC
|
|
MCULE-5967042891 |
0.85 |
[C@]12(C)CCC3[C@@]([H])(CC([C@@]4([H])CC=CC[C@]34C)=O)C1CCC2[C@H](C)[C@@H](O)[C@H](O)[C@H](C)C(C)C
|
|
MCULE-2615091969 |
0.85 |
O=C1C(C2CCCCC2)CC2C1(C)CCC1C2CC=C2CC(O)CCC21C
|
|
MCULE-7491068561 |
0.85 |
[C@]12(C)CCC3[C@@]([H])(CC=C4C[C@@H](O)CC[C@]34C)C1C[C@@H](C)[C@@H]2C(C)=O
|
|
MCULE-1308336736 |
0.85 |
C12=CC[C@]3([C@@](C)(CC[C@@]4([H])C(C(O)CC[C@]34C)(C)C)[C@]1(C)CC[C@]1(CC[C@@H](C)C(C)C21)C(O)=O)[H]
|
|
MCULE-9526433855 |
0.85 |
[C@]12(C)CCC3[C@@]([H])(CC=C4CC(O)CC[C@]34C)C1C[C@@H](C)[C@]2(C)C(C)=O
|
|
MolPort-046-761-810 |
0.85 |
[2H]C1=C2C([2H])([2H])[C@@]([2H])(O)C([2H])([2H])C[C@]2(C)[C@H]2CC[C@@]3(C)[C@@H](CC([2H])([2H])C3=O)[C@@H]2C1
|
|
MolPort-039-138-853 |
0.85 |
CCCCC1[C@H]2CC(=O)[C@H](C\C=C/CCCC(O)=O)[C@H]2CCC1=O
|
|
MolPort-003-666-312 |
0.85 |
CC(=O)[C@H]1CCC2C3CC=C4C[C@@H](O)CC[C@]4(C)C3CC[C@]12C
|
|
MolPort-002-158-261 |
0.85 |
CC(=O)C12CCCCC1CC1C3CC=C4CC(O)CCC4(C)C3CCC21C
|
|
MolPort-002-507-280 |
0.85 |
C[C@@H]1CC[C@@]2(CC[C@]3(C)C(=CC[C@@H]4[C@@]5(C)CCC(O)C(C)(C)[C@@H]5CC[C@@]34C)C2C1C)C(O)=O
|
|
MolPort-035-706-531 |
0.85 |
CC1(C)CC[C@]2(C)CC[C@]3(C)C(=CC(=O)[C@@H]4[C@@]5(C)CC[C@H](O)C(C)(C)[C@@H]5CC[C@@]34C)[C@@H]2C1
|
|
MolPort-039-338-864 |
0.85 |
C[C@@H]1CC[C@@]2(CC[C@]3(C)C(=CC[C@@H]4[C@@]5(C)CC[C@@H](O)C(C)(C)[C@@H]5CC[C@@]34C)[C@@H]2[C@H]1C)C(O)=O
|
|
MolPort-039-338-968 |
0.85 |
CC1(C)CC[C@@]2(CC[C@]3(C)C(=CC[C@@H]4[C@@]5(C)CC[C@@H](O)C(C)(C)[C@@H]5CC[C@@]34C)[C@@H]2C1)C(O)=O
|
|
MolPort-001-740-060 |
0.85 |
C[C@]12CCC3C(CC=C4C[C@@H](O)CC[C@]34C)C1CCC2=O
|
|
MolPort-001-740-468 |
0.85 |
C[C@@H]1CC[C@@]2(CC[C@]3(C)C(=CCC4[C@@]5(C)CC[C@H](O)C(C)(C)C5CC[C@@]34C)C2[C@H]1C)C(O)=O
|
|
MolPort-002-522-274 |
0.85 |
CC(=O)[C@H]1CCC2[C@@H]3CC=C4C[C@@H](O)CC[C@]4(C)C3CC[C@]12C
|
|
MolPort-002-506-906 |
0.85 |
CC(=O)[C@H]1CC[C@H]2[C@@H]3CC=C4C[C@@H](O)CC[C@]4(C)[C@H]3CC[C@]12C
|
|
MolPort-001-736-568 |
0.85 |
CC1(C)CCC2(CCC3(C)C(=CCC4C5(C)CCC(O)C(C)(C)C5CCC34C)C2C1)C(O)=O
|
|
MolPort-002-911-249 |
0.85 |
CC(CCCC(C)=O)C1CCC2C3CC=C4CC(O)CCC4(C)C3CCC12C
|
|
MolPort-000-729-105 |
0.85 |
CC1(C)CCC2(CC[C@]3(C)C(=CCC4C5(C)CCC(O)C(C)(C)C5CCC34C)C2C1)C(O)=O
|
|
MolPort-042-675-343 |
0.85 |
CC1(C)CC[C@]2(C)CC[C@]3(C)C(=CC(=O)C4[C@@]5(C)CC[C@H](O)C(C)(C)C5CC[C@@]34C)[C@@H]2C1
|
|
MolPort-046-589-954 |
0.85 |
C[C@]12CC[C@H]3[C@@H](CC=C4C[C@H](O)CC[C@]34C)[C@@H]1CCC2=O
|
|
MolPort-000-720-642 |
0.85 |
CC(=O)C1CCC2C3CC=C4CC(O)CCC4(C)C3CCC12C
|
|
MolPort-002-507-433 |
0.85 |
CC1(C)CC[C@@]2(CC[C@]3(C)C(=CCC4[C@@]5(C)CC[C@@H](O)C(C)(C)C5CC[C@@]34C)[C@@H]2C1)C(O)=O
|
|
MolPort-002-507-455 |
0.85 |
C[C@@H]1CC2[C@@H]3CC=C4CC(O)CC[C@]4(C)C3CC[C@]2(C)[C@@]1(C)C(C)=O
|
|
MolPort-020-005-912 |
0.85 |
CC1(C)CC[C@@]2(CC[C@]3(C)C(=CC[C@@H]4[C@@]5(C)CCC(=O)C(C)(C)[C@@H]5CC[C@@]34C)[C@@H]2C1)C(O)=O
|
|
MolPort-002-534-996 |
0.85 |
C[C@@H]1CCC2(CC[C@]3(C)C(=CC[C@@H]4[C@@]5(C)CCC(O)C(C)(C)[C@@H]5CC[C@@]34C)C2C1C)C(O)=O
|
|
MolPort-046-597-698 |
0.85 |
C[C@@H]1CC2C3CC=C4CC(O)CC[C@]4(C)C3CC[C@]2(C)C1C(C)=O
|
|
MolPort-046-596-590 |
0.85 |
CC(=O)C12CCCC[C@@H]1C[C@H]1C3CC=C4CC(O)CC[C@]4(C)C3CC[C@]21C
|
|
MolPort-003-983-927 |
0.85 |
C[C@@H]1CC[C@@]2(CC[C@]3(C)C(=CC[C@@H]4[C@@]5(C)CC[C@H](O)C(C)(C)C5CC[C@@]34C)[C@@H]2[C@H]1C)C(O)=O
|
|
MolPort-002-678-933 |
0.85 |
CC1=C(C)CC(CC1)C(O)=O
|
|
MolPort-046-596-264 |
0.85 |
C[C@@H]1CC2C3CC=C4CC(O)CC[C@]4(C)C3CC[C@]2(C)[C@@]1(C)C(C)=O
|
|
MolPort-044-193-919 |
0.85 |
CC1CCC2(CCC3(C)C(=CCC4C5(C)CCC(=O)C(C)(C)C5CCC34C)C2C1C)C(O)=O
|
|
MolPort-044-615-514 |
0.85 |
CC1=C(C)CC(C)(CC1)C(O)=O
|
|
MolPort-004-955-261 |
0.85 |
CC1(C)CC[C@@]2(CC[C@]3(C)C(=CC[C@@H]4[C@@]5(C)CC[C@H](O)C(C)(C)[C@@H]5CC[C@@]34C)[C@@H]2C1)C(O)=O
|
|
MolPort-008-430-076 |
0.85 |
C[C@@H]1CC[C@@]2(CC[C@]3(C)C(=CCC4[C@@]5(C)CCC(O)C(C)(C)C5CC[C@@]34C)C2C1C)C(O)=O
|
|
MolPort-005-909-640 |
0.85 |
CC(C)[C@@H](C)[C@@H](O)[C@H](O)[C@@H](C)C1CCC2[C@@H]3CC(=O)[C@H]4CC=CC[C@]4(C)C3CC[C@]12C
|
|
MolPort-003-891-893 |
0.85 |
CC12CCC3C(CC=C4CC(O)CCC34C)C1CCC2=O
|
|
MolPort-022-368-244 |
0.85 |
CC1=CCC(C)(CC1)C(O)=O
|
|
MolPort-046-765-250 |
0.85 |
C[C@@H](C=O)[C@H]1CC[C@@H]2[C@@H]3CC=C4C[C@@H](O)CC[C@]4(C)[C@@H]3CC[C@]12C
|
|
MolPort-003-929-763 |
0.85 |
C[C@]12CC[C@H]3[C@@H](CC=C4C[C@@H](O)CC[C@]34C)[C@@H]1CCC2=O
|
|
MolPort-046-419-080 |
0.85 |
C[C@H](CCC=O)[C@H]1CC[C@H]2[C@@H]3CC=C4C[C@@H](O)CC[C@]4(C)[C@H]3CC[C@]12C
|
|
MolPort-002-525-209 |
0.85 |
C[C@H](CCCC(C)=O)[C@H]1CCC2[C@@H]3CC=C4C[C@@H](O)CC[C@]4(C)C3CC[C@]12C
|
|
MolPort-046-764-596 |
0.85 |
CC(CCCC(C)=O)[C@H]1CC[C@H]2[C@@H]3CC=C4C[C@@H](O)CC[C@]4(C)[C@H]3CC[C@]12C
|
|
MolPort-002-525-147 |
0.85 |
C[C@H]1CC[C@@]2(CC[C@]3(C)C(=CCC4[C@@]5(C)CC[C@H](O)C(C)(C)C5CC[C@@]34C)[C@@H]2[C@@H]1C)C(O)=O
|
|
MolPort-009-198-793 |
0.85 |
CC(=O)[C@H]1CC[C@H]2[C@@H]3CC=C4CC(O)CC[C@]4(C)[C@H]3CC[C@]12C
|
|
MolPort-002-527-265 |
0.85 |
C[C@]12CCC3[C@@H](CC=C4C[C@@H](O)CC[C@]34C)C1CCC2=O
|
|
MolPort-046-691-997 |
0.85 |
[2H]C([2H])([2H])C(=O)[C@@]1([2H])CC[C@H]2[C@@H]3CC=C4C[C@@H](O)CC[C@]4(C)[C@H]3CC[C@]12C
|
|
MolPort-046-762-480 |
0.85 |
CC(=O)[C@H]1CC[C@H]2[C@@H]3CC=C4C[C@H](O)CC[C@]4(C)[C@H]3CC[C@]12C
|
|
MolPort-001-740-955 |
0.85 |
CC(CC[C@@]1(C)[C@H](C)CC[C@]2(C)C1CCC=C2CO)CC(O)=O
|
|
MolPort-001-741-050 |
0.85 |
CC1(C)CC[C@@]2(CC[C@]3(C)C(=CCC4[C@@]5(C)CC[C@H](O)C(C)(C)C5CC[C@@]34C)C2C1)C(O)=O
|
|
MolPort-003-939-637 |
0.85 |
C[C@@H]1CC[C@@]2(CC[C@]3(C)C(=CC[C@@H]4[C@@]5(C)CC[C@H](O)C(C)(C)[C@@H]5CC[C@@]34C)[C@@H]2[C@H]1C)C(O)=O
|
|
MolPort-027-834-998 |
0.85 |
CC1(C)CC[C@@]2(CC[C@]3(C)C(=CC[C@@H]4[C@@]5(C)CC[C@H](O)C(C)(C)C5CC[C@@]34C)[C@H]2C1)C(O)=O
|
|
MolPort-002-524-169 |
0.85 |
C[C@@H]1CC2[C@@H]3CC=C4C[C@@H](O)CC[C@]4(C)C3CC[C@]2(C)[C@H]1C(C)=O
|
|
MolPort-035-784-288 |
0.85 |
O.CC1(C)CC[C@@]2(CC[C@]3(C)C(=CC[C@@H]4[C@@]5(C)CC[C@H](O)C(C)(C)[C@@H]5CC[C@@]34C)[C@@H]2C1)C(O)=O
|
|
MolPort-022-366-438 |
0.85 |
CC1=CCC(CC1)C(O)=O
|
|
MolPort-027-835-590 |
0.85 |
C[C@@H]1CC[C@@]2(CC[C@]3(C)C(=CC[C@@H]4[C@@]5(C)CCC(=O)C(C)(C)[C@@H]5CC[C@@]34C)[C@@H]2[C@H]1C)C(O)=O
|
|
MolPort-002-525-706 |
0.85 |
CC(=O)[C@@]12CCCC[C@@H]1C[C@H]1[C@@H]3CC=C4C[C@@H](O)CC[C@]4(C)C3CC[C@]21C
|
|
MolPort-035-706-538 |
0.84 |
CC1(C)C[C@@H](O)[C@]2(C)CC[C@]3(C)C(=CC[C@@H]4[C@@]5(C)CCC(=O)[C@](C)(CO)[C@@H]5CC[C@@]34C)[C@@H]2C1
|
|
MolPort-035-706-537 |
0.84 |
CC1(C)C[C@H]2C3=CC[C@@H]4[C@@]5(C)CCC(=O)[C@](C)(CO)[C@@H]5CC[C@@]4(C)[C@]3(C)CC[C@@]2(C)C(=O)C1
|
|
MCULE-4002345426 |
0.84 |
C1(CCCC(=CCC2C(C)(CCC2C(=C)C)CC1)C)C(=O)O
|
|
MCULE-2170508823 |
0.84 |
C12C3C4C5C1C(C1C5C(C4CC3CC(O)=O)CC1CC(O)=O)C=C2
|
|
MCULE-6413909495 |
0.84 |
CCCCCCCC/C=C\CCCCCCC(C(=O)O)O
|
|
MolPort-046-589-760 |
0.84 |
CCCCCCCC\C=C/CCCCCCC(O)C(O)=O
|
|
MolPort-002-507-350 |
0.83 |
CC(C)C1=CC2=CC[C@@H]3[C@](C)(CCC[C@@]3(C)C(O)=O)[C@H]2CC1
|
|
MolPort-046-790-504 |
0.83 |
CC1=C2C[C@@H](CC[C@@]2(C)CCC1=O)C(=C)C(O)=O
|
|
MolPort-023-221-456 |
0.83 |
CC(C)C1=CC2=CCC3[C@](C)(CCC[C@]3(C)C(O)=O)[C@@H]2CC1
|
|
MolPort-002-135-152 |
0.83 |
OC(=O)C1C2CCCCC2=C2CCCCC2C1C(O)=O
|
|
MolPort-035-683-228 |
0.83 |
CC(C)C1=CC2=CCC3[C@](C)(CCC[C@@]3(C)C(O)=O)[C@H]2CC1
|
|
MolPort-016-584-038 |
0.83 |
CC1(C(C2CCCCC2=C2CCCCC12)C(O)=O)C(O)=O
|
|
MolPort-001-816-138 |
0.83 |
OC(=O)C1CC2CC=CC(C1)C2=O
|
|
MolPort-001-781-437 |
0.83 |
CC(C)C1=CC2=CCC3C(C)(CCCC3(C)C(O)=O)C2CC1
|
|
MolPort-035-706-309 |
0.83 |
CC(C)[C@H]1CC[C@@H]2[C@]1(C)CC[C@]1(C)C3=CC[C@H]4C(C)(C)C(=O)[C@]3(CC[C@@]21C)[C@@]4(C)CC(O)=O
|
|
MolPort-028-606-852 |
0.83 |
CC(C)C1=CC2=CCC3C(C)(CCCC3(C)C([O-])=O)C2CC1
|
|
MolPort-002-910-713 |
0.83 |
OC(=O)C1C2CCC(C=C2)C1C(O)=O
|
|
MCULE-2721005128 |
0.83 |
C1CC2(C(CC=1)(C(O)=O)CCCC2)CC(O)=O
|
|
MCULE-8297574712 |
0.83 |
C1(C2CCC(C=C2)C1C(O)=O)C(O)=O
|
|
MCULE-9700928997 |
0.83 |
C12CCCCC1C(C(O)=O)C(C1CCCCC=21)C(O)=O
|
|
MCULE-2458381576 |
0.83 |
C1C2C(=O)C(CC(C(=O)O)C2)C=C1
|
|
MCULE-9085462824 |
0.83 |
OC(C1C(CC2CC=CC2)CCCC1)=O
|
|
MCULE-2496014695 |
0.83 |
C1(C)(C(O)=O)C2CCCCC2=C2C(CCCC2)C1C(O)=O
|
|
MCULE-3023348221 |
0.83 |
C1(C)(CC2CC1C=C2)C(O)=O
|
|
MCULE-8031195256 |
0.83 |
[C@]12(C(=C[C@@H](O)CC1)[C@@H](C[C@@]1([C@]2([H])CC[C@]2([C@@]1([H])CC[C@]2([H])[C@H](C)CCC(O)=O)C)[H])O)C
|
|
MCULE-2700455616 |
0.83 |
C1CC2(C)C3C(=O)C=C4C5C(C)C(C)CCC5(C)CCC4(C)C3(C)CCC2C(C)(C(=O)O)C1O
|
|
MCULE-1857694923 |
0.83 |
[C@@]12([H])C[C@@]([H])(C=C1)C[C@@H]2C(O)=O
|
|
MCULE-5677861178 |
0.83 |
[C@H]1(C(O)=O)[C@]2([H])C[C@]([H])(C1)C=C2
|
|
MCULE-4737898468 |
0.83 |
[H]C12CC(O)CCC1(C)C1CCC3(C)C(C(C)C=CC(C)C(C)C)CCC3C=1C(C2)=O
|
|
MCULE-7626806338 |
0.83 |
C1CC2(C)C3CC=C4C5C(C)C(C)C(O)CC5(C(=O)O)CCC4(C)C3(C)CCC2C(C)(C)C1O
|
|
MCULE-9707443606 |
0.83 |
C1C[C@]2(C)[C@@]3([H])C(=O)C=C4[C@]5([H])[C@@H](C)[C@H](C)CC[C@]5(C)CC[C@@]4(C)[C@]3(C)CC[C@@]2([H])[C@@](C)(C(=O)O)[C@@H]1O
|
|
MCULE-1877150050 |
0.83 |
C12(C)CCC(O)CC1=CCC1C2CCC2(C)C(CCC21)(O)CCC(O)=O
|
|
MCULE-2570487264 |
0.83 |
OC(C1C2C=CC(C2)C1)=O
|
|
MCULE-6464655857 |
0.83 |
C1C[C@@]2([H])[C@H](C)CC[C@@]([H])([C@@H](C)C(=O)O)[C@@]2([H])C(=O)C=1C
|
|
MCULE-9341959688 |
0.83 |
[C@]12(C)CC[C@]3([C@@]([H])(CC=C4C[C@@H](O)CC[C@]34C)[C@]1([H])C[C@@]1([H])CC=CC[C@@]21C(C)=O)[H]
|
|
MolPort-001-794-999 |
0.83 |
OC(=O)[C@@H]1C[C@H]2C[C@@H]1C=C2
|
|
MolPort-035-706-383 |
0.83 |
CC1(C)CC[C@@]2(CC[C@]3(C)C(=CC[C@@H]4[C@@]5(C)CC[C@H](O)[C@@](C)(CO)[C@@H]5[C@H](O)C[C@@]34C)[C@@H]2C1)C(O)=O
|
|
MolPort-001-794-998 |
0.83 |
OC(=O)[C@H]1C[C@H]2C[C@@H]1C=C2
|
|
MolPort-000-653-714 |
0.83 |
OC(=O)C1CC2CC1C=C2
|
|
MolPort-046-627-162 |
0.83 |
CC1C(C)C2C3=CCC4C5(C)CCC(O)C(C)(C)C5CCC4(C)C3(C)CCC2(CC1O)C(O)=O
|
|
MolPort-044-637-462 |
0.83 |
CC1CCC2(C)CCC3(C)C(=CC(=O)C4C5(C)CCC(O)C(C)(C5CCC34C)C(O)=O)C2C1C
|
|
MolPort-046-196-745 |
0.83 |
C[CH]C1CC[C]2[C]1CCC1[C]3C[CH][C@H](O)C[C@H]3C(=O)C=C21
|
|
MolPort-046-790-505 |
0.83 |
C[C@H]1CC(=O)C=C2CC[C@H](C[C@]12C)C(=C)C(O)=O
|
|
MolPort-009-014-456 |
0.83 |
C[C@H](CCC(O)=O)[C@H]1CC[C@H]2[C@@H]3C[C@@H](O)C4=C[C@@H](O)CC[C@]4(C)[C@H]3CC[C@]12C
|
|
MolPort-035-706-203 |
0.83 |
C[C@H]([C@@H]1CC[C@@H](C)[C@@H]2CC=C(C)C(=O)[C@H]12)C(O)=O
|
|
MolPort-044-564-431 |
0.83 |
CC(=O)C12CC=CC[C@@H]1C[C@H]1C3CC=C4CC(O)CC[C@]4(C)C3CC[C@]21C
|
|
MolPort-001-792-423 |
0.83 |
OC(=O)C1C[C@H]2C[C@@H]1C=C2
|
|
MolPort-002-481-549 |
0.83 |
CC1(C[C@@H]2C[C@H]1C=C2)C(O)=O
|
|
MolPort-007-567-460 |
0.83 |
CC(=O)C12CC=CCC1CC1C3CC=C4CC(O)CC[C@]4(C)C3CC[C@]21C
|
|
MolPort-039-338-840 |
0.83 |
C[C@H](CC\C=C(/C)C=O)[C@H]1CC[C@@]2(C)C3=C(CC[C@]12C)[C@@]1(C)CC[C@H](O)C(C)(C)C1CC3=O
|
|
MolPort-039-333-691 |
0.83 |
OC(=O)[C@H]1C[C@@H]2C[C@H]1C=C2
|
|
MolPort-046-761-019 |
0.83 |
CC1(C)CC[C@@]2(CC[C@]3(C)C(=CC[C@H]4[C@@]3(C)CC[C@H]3C(C)(C)[C@@H](O)CC(=O)[C@]43C)[C@@H]2C1)C(O)=O
|
|
MolPort-028-745-366 |
0.83 |
CC(C)=CCCC1=CCC(CC1)C(O)=O
|
|
MolPort-046-688-079 |
0.83 |
CC(C1CC=C(C)C(=O)C1)C(O)=O
|
|
MolPort-002-526-219 |
0.83 |
CC(=O)[C@@]12CC=CC[C@@H]1C[C@H]1[C@@H]3CC=C4C[C@@H](O)CC[C@]4(C)[C@H]3CC[C@]21C
|
|
MolPort-035-706-403 |
0.83 |
CC1(C)[C@H](O)CC[C@@]2(C)[C@H]1CC[C@@]1(C)CC3=CC(=O)[C@H]4C(C)(C)[C@H](O)CC[C@]4(C)[C@H]3CC[C@H]21
|
|
MolPort-016-638-416 |
0.83 |
C[C@@H]1CC[C@]2(C)CC[C@]3(C)C(=CC(=O)C4[C@@]5(C)CC[C@@H](O)[C@@](C)(C5CC[C@@]34C)C(O)=O)C2[C@H]1C
|
|
MolPort-000-145-710 |
0.83 |
CC1(CC2CC1C=C2)C(O)=O
|
|
MolPort-001-742-062 |
0.83 |
CC1=CC(=O)C[C@]2(C)CC[C@H](CC12)C(=C)C(O)=O
|
|
MolPort-020-005-948 |
0.83 |
C[C@@H]1CC[C@]2(C)CC[C@]3(C)C(=CC(=O)[C@@H]4[C@@]5(C)CC[C@@H](O)[C@@](C)([C@@H]5CC[C@@]34C)C(O)=O)[C@@H]2[C@H]1C
|
|
MolPort-046-596-589 |
0.83 |
CC(=O)C12CC=CC[C@@H]1C[C@H]1[C@@H]3CC=C4CC(O)CC[C@]4(C)[C@H]3CC[C@]21C
|
|
MolPort-006-111-348 |
0.83 |
CC1(C)CC[C@@]2(CC[C@]3(C)C(=CC[C@@H]4[C@@]5(C)CC[C@H](O)[C@@](C)(CO)[C@@H]5CC[C@@]34C)[C@@H]2C1)C(O)=O
|
|
MolPort-002-506-984 |
0.83 |
C[C@@H]1C[C@H]2[C@@H]3CC=C4C[C@@H](O)CC[C@]4(C)[C@H]3CC[C@]2(C)[C@@]1(O)C(C)=O
|
|
MolPort-006-111-052 |
0.83 |
C[C@H](O)[C@H]1CC[C@H]2[C@@H]3CCC4=CC(=O)CC[C@]4(C)[C@H]3CC[C@]12C
|
|
MolPort-044-183-134 |
0.83 |
CC1(C)CC[C@@]2(CC[C@]3(C)C(=CC[C@@H]4[C@@]5(C)C[C@@H](O)[C@H](O)C(C)(C)C5CC[C@@]34C)[C@H]2C1)C(O)=O
|
|
MolPort-006-069-421 |
0.83 |
C[C@@H](O)[C@H]1CC[C@H]2[C@@H]3CCC4=CC(=O)CC[C@]4(C)[C@H]3CC[C@]12C
|
|
MolPort-006-069-150 |
0.83 |
CC(=O)[C@@]1(O)CC[C@H]2[C@@H]3CC=C4C[C@@H](O)CC[C@]4(C)[C@H]3CC[C@]12C
|
|
MolPort-002-506-869 |
0.83 |
C[C@]12CCC3[C@@H](CC=C4C[C@@H](O)CC[C@]34CO)C1CCC2=O
|
|
MolPort-042-675-461 |
0.83 |
C[C@@H]1CC[C@@]2(CC[C@]3(C)C(=CCC4[C@@]5(C)C[C@@H](O)[C@@H](O)C(C)(C)C5CC[C@@]34C)[C@@H]2[C@H]1C)C(O)=O
|
|
MolPort-046-596-387 |
0.83 |
CC(C)CCCC(C)C1CC(=O)C2=C3CCC4CC(O)CC[C@]4(C)C3CC[C@]12C
|
|
MolPort-046-596-363 |
0.83 |
C[C@@H]1CC2C3CCC4=CC(O)CC[C@]4(C)C3CC[C@]2(C)[C@@]1(C)C(C)=O
|
|
MolPort-005-937-958 |
0.83 |
C[C@]1(O)CC[C@H]2[C@@H]3CC[C@H]4CC(=O)C=C[C@]4(C)[C@H]3CC[C@]12C
|
|
MolPort-004-285-983 |
0.83 |
CC[C@]1(O)CC[C@H]2[C@@H]3CCC4=CC(=O)CC[C@@H]4[C@H]3CC[C@]12C
|
|
MolPort-004-956-486 |
0.83 |
C[C@]12CC[C@H]3[C@@H](CC=C4C[C@@H](O)CC[C@]34C)[C@@H]1CC[C@@H]2C(=O)CO
|
|
MolPort-046-417-742 |
0.83 |
C[C@@H]1CC2=CC(=O)CC[C@@H]2[C@H]2CC[C@]3(C)[C@@H](O)CC[C@H]3[C@H]12
|
|
MolPort-002-526-688 |
0.83 |
C[C@]12CCC3[C@@H](CCC4=C[C@H](O)CC[C@]34C)C1CCC2=O
|
|
MolPort-044-755-246 |
0.83 |
CC(=O)[C@H]1[C@H](O)C[C@H]2[C@@H]3CC=C4C[C@@H](O)CC[C@]4(C)[C@H]3CC[C@]12C
|
|
MolPort-002-512-678 |
0.83 |
C[C@@H]1CC2[C@@H]3CCC4=C[C@@H](O)CC[C@]4(C)C3CC[C@]2(C)[C@@]1(C)C(C)=O
|
|
MolPort-002-911-071 |
0.83 |
C[C@@H]1CC2(C)C3CCC4(C)C(CC[C@]4(C)O)C3CCC2=CC1=O
|
|
MolPort-002-911-080 |
0.83 |
C[C@]1(O)CCC2C3CCC4=CC(=O)CCC4C3CCC12C
|
|
MolPort-002-911-141 |
0.83 |
CC(O)C1CCC2C3CCC4=CC(=O)CCC4(C)C3CCC12C
|
|
MolPort-002-911-148 |
0.83 |
CCC1=C2CCC3C4CC[C@](C)(O)C4(C)CCC3C2(C)CCC1=O
|
|
MolPort-044-649-711 |
0.83 |
CC1(C)CC[C@@]2(CC[C@]3(C)C(=CC[C@@H]4[C@@]5(C)C[C@@H](O)C(=O)C(C)(C)[C@@H]5CC[C@@]34C)[C@@H]2C1)C(O)=O
|
|
MolPort-002-524-878 |
0.83 |
CC1(C)CC[C@@]2(CC[C@]3(C)C(=CCC4[C@@]5(C)CC(O)[C@@H](O)C(C)(C)C5CC[C@@]34C)[C@@H]2C1)C(O)=O
|
|
MolPort-002-520-919 |
0.83 |
C[C@]12CC[C@H]3[C@@H](CCC4=CC(=O)CCC34)[C@@H]1CCC2O
|
|
MolPort-003-848-014 |
0.83 |
[2H]C([2H])([2H])C(=O)[C@@]1(O)CC[C@H]2[C@@H]3CC=C4C[C@@H](O)CC[C@]4(C)[C@H]3CC[C@]12C
|
|
MolPort-002-527-294 |
0.83 |
CC(C)CCC[C@@H](C)[C@H]1CC(=O)C2=C3CC[C@H]4C[C@H](O)CC[C@]4(C)C3CC[C@]12C
|
|
MolPort-003-849-312 |
0.83 |
C[C@]12CC[C@H]3[C@@H](CCC4=CC(=O)CC[C@H]34)[C@@H]1CC[C@@H]2O
|
|
MolPort-002-521-548 |
0.83 |
C[C@@H]1C[C@H]2[C@@H]3CC=C4CC(O)CC[C@]4(C)[C@H]3CC[C@]2(C)[C@@]1(O)C(C)=O
|
|
MolPort-002-526-059 |
0.83 |
C[C@]1(O)CCC2[C@@H]3CC[C@H]4CC(=O)C=C[C@]4(C)C3CC[C@]12C
|
|
MolPort-046-793-369 |
0.83 |
[2H][C@@H]1C[C@H]2[C@H]3CC[C@@H]([C@@H](C)O)[C@@]3(C)CCC2[C@@]2(C)CC([2H])([2H])C(=O)C([2H])=C12
|
|
MolPort-019-937-217 |
0.83 |
CC1(C)CC[C@@]2(CC[C@]3(C)C(=CCC4[C@@]5(C)CC[C@H](O)[C@@](C)(CO)C5CC[C@@]34C)[C@@H]2C1)C(O)=O
|
|
MolPort-046-690-504 |
0.83 |
C[C@@]1(O)CC[C@H]2[C@@H]3CCC4=CC(=O)CC[C@]4(C)[C@H]3CC[C@]12C
|
|
MolPort-039-338-353 |
0.83 |
CC1(C)CC[C@@]2(CC[C@]3(C)C(=CC[C@@H]4[C@@]5(C)C[C@@H](O)[C@@H](O)C(C)(C)[C@@H]5CC[C@@]34C)[C@@H]2C1)C(O)=O
|
|
MolPort-039-338-302 |
0.83 |
C[C@@H]1CC[C@]2(C)[C@H](CC(=O)C=C2C)[C@@]1(C)CC[C@@](C)(O)C=C
|
|
MolPort-046-692-950 |
0.83 |
C[C@]12CC[C@H]3[C@@H](CC[C@H]4C[C@H](O)C=C[C@]34C)[C@@H]1CCC2=O
|
|
MolPort-046-693-069 |
0.83 |
C[C@]12CC[C@H]3[C@@H](CC[C@H]4C[C@@H](O)C=C[C@]34C)[C@@H]1CCC2=O
|
|
MolPort-046-693-157 |
0.83 |
CC1=C[C@@]2(C)[C@@H](CC[C@H]3[C@@H]4CC[C@](C)(O)[C@@]4(C)CC[C@H]23)CC1=O
|
|
MolPort-019-937-078 |
0.83 |
C[C@@H]1CC[C@@]2(CC[C@]3(C)C(=CCC4[C@@]5(C)C[C@@H](O)[C@H](O)C(C)(C)C5CC[C@@]34C)[C@@H]2[C@H]1C)C(O)=O
|
|
MolPort-002-510-419 |
0.83 |
C[C@@H]1CC2[C@@H]3CC=C4C[C@@H](O)CC[C@]4(C)C3CC[C@]2(C)[C@@]1(O)C(C)=O
|
|
MolPort-001-785-932 |
0.83 |
CC1(O)CCC2C3CCC4=CC(=O)CCC4(C)C3CCC12C
|
|
MolPort-019-997-276 |
0.83 |
C[C@]12CCC3C(CCC4=CC(=O)CCC34)C1CCC2O
|
|
MolPort-020-005-953 |
0.83 |
C[C@@H]1CC[C@@]2(CC[C@]3(C)C(=CC[C@@H]4[C@@]5(C)C[C@@H](O)[C@H](O)C(C)(C)[C@@H]5CC[C@@]34C)[C@@H]2[C@H]1C)C(O)=O
|
|
MolPort-021-783-255 |
0.83 |
CC1(C)CC[C@@]2(CC[C@]3(C)C(=CC[C@@H]4[C@@]5(C)C[C@@H](O)[C@H](O)C(C)(C)[C@@H]5CC[C@@]34C)[C@@H]2C1)C(O)=O
|
|
MolPort-046-762-885 |
0.83 |
CC1(C)CC[C@@]2(CC[C@]3(C)C(=CC[C@@H]4[C@@]5(C)CC[C@H](O)[C@@](C)(CO)C5CC[C@@]34C)[C@H]2C1)C(O)=O
|
|
MolPort-046-764-442 |
0.83 |
[2H]C1=C2C([2H])([2H])C[C@H]3[C@@H]4CC[C@@](C)(O)[C@@]4(C)CC[C@@H]3[C@@]2(C)CC([2H])([2H])C1=O
|
|
MolPort-046-764-565 |
0.83 |
C[C@]12CC[C@H]3[C@@H](CCC4=C[C@H](O)CC[C@H]34)[C@@H]1CCC2=O
|
|
MolPort-046-765-305 |
0.83 |
CC1=C2CC[C@H]3[C@H]4CCC(C)(O)[C@@]4(C)CC[C@H]3[C@@]2(C)CCC1=O
|
|
MolPort-046-765-340 |
0.83 |
C[C@]12CC[C@H]3[C@@H](CC[C@@H]4CC(=O)C=C[C@]34C)[C@@H]1CC[C@@H]2O
|
|
MolPort-046-765-461 |
0.83 |
C[C@]12CCC(=O)C=C1CC[C@@H]1[C@H]2CC[C@@]2(C)[C@H]1CCC(=O)[C@@]2(C)O
|
|
MolPort-046-765-469 |
0.83 |
C[C@H]1C[C@@H]2[C@H](CC[C@@]3(C)[C@H]2CCC(=O)[C@]3(C)O)[C@@]2(C)CCC(=O)C=C12
|
|
MolPort-001-740-467 |
0.83 |
CC1(C)CC[C@@]2(CC[C@]3(C)C(=CCC4[C@@]5(C)C[C@@H](O)[C@H](O)C(C)(C)C5CC[C@@]34C)C2C1)C(O)=O
|
|
MolPort-046-765-861 |
0.83 |
[2H][C@@H]1C[C@H]2[C@H]3CC[C@@H](C(C)O)[C@]3(C)CC[C@H]2[C@@]2(C)CC([2H])([2H])C(=O)C([2H])=C12
|
|
MolPort-028-599-905 |
0.83 |
C[C@@H]1CC[C@@]2(CC[C@]3(C)C(=CC[C@@H]4[C@@]5(C)C[C@@H](O)[C@@H](O)C(C)(C)[C@@H]5CC[C@@]34C)[C@@H]2[C@H]1C)C(O)=O
|
|
MolPort-000-831-717 |
0.83 |
C[C@@H]1CC2C3CC=C4CC(O)CC[C@]4(C)C3CC[C@]2(C)[C@@]1(O)C(C)=O
|
|
MolPort-035-706-389 |
0.83 |
CC1(C)CC[C@@]2(CC[C@]3(C)C(=CC[C@@H]4[C@@]5(C)CC[C@@H](O)[C@@](C)(CO)[C@@H]5CC[C@@]34C)[C@@H]2C1)C(O)=O
|
|
MolPort-035-706-388 |
0.83 |
CC1(C)CC[C@@]2(CC[C@]3(C)C(=CC[C@@H]4[C@@]5(C)CCC(=O)[C@@](C)(CO)[C@@H]5CC[C@@]34C)[C@@H]2C1)C(O)=O
|
|
MolPort-035-706-386 |
0.83 |
CC1(C)CC[C@@]2(CC[C@]3(C)C(=CC[C@@H]4[C@@]5(C)CC[C@@H](O)[C@](C)(CO)[C@@H]5CC[C@@]34C)[C@@H]2C1)C(O)=O
|
|
MolPort-000-726-918 |
0.83 |
C[C@@H]1CC2C3CC=C4CC(O)CCC4(C)C3CCC2(C)[C@@]1(O)C(C)=O
|
|
MolPort-030-042-288 |
0.83 |
CC12CCC3C(CC=C4CC(O)CCC34CO)C1CCC2=O
|
|
MolPort-046-793-201 |
0.83 |
C[C@]12CC[C@H]3[C@@H](CCC4=C[13C](=O)CC[C@]34C)[C@@H]1CC[C@@H]2O
|
|
MolPort-000-146-103 |
0.83 |
CC(C)CCC[C@@H](C)[C@H]1CC(=O)C2=C3CC[C@H]4C[C@@H](O)CC[C@]4(C)C3CC[C@]12C
|
|
MolPort-002-800-539 |
0.83 |
CC12CCC3C(CCC4=CC(O)CCC34C)C1CCC2=O
|
|
MolPort-046-691-031 |
0.83 |
[2H]C1([2H])C[C@H]2[C@@H]3CCC4=CC(=O)CC[C@]4(C)[C@H]3CC[C@]2(C)[C@]1([2H])O
|
|
MolPort-002-507-282 |
0.83 |
CC1(O)CCC2C3CCC4=CC(=O)CC[C@]4(C)C3CC[C@]12C
|
|
MolPort-046-596-410 |
0.83 |
C[C@]1(O)CCC2C3CC[C@H]4CC(=O)C=C[C@]4(C)C3CC[C@]12C
|
|
MolPort-002-507-387 |
0.83 |
C[C@]1(O)CCC2[C@@H]3CCC4=CC(=O)CC[C@]4(C)C3CC[C@]12C
|
|
MCULE-7633761938 |
0.82 |
C(O)(C1CCC2(C)C3CCC4(C)C(C(C)CCCC(C)C)CCC4C3CC=C2C1)=O
|
|
MCULE-1657159254 |
0.82 |
[C@@]12(C)[C@@H](O)CC[C@@]1([H])[C@]1([C@@]([H])([C@H]3CCC(C=C3CC1)=O)CC2)[H]
|
|
MCULE-4241274271 |
0.82 |
C1(=O)C[C@]2([H])[C@@](C)(CC[C@@](O)(C=C)C)[C@H](C)CC[C@@]2(C)C(C)=C1
|
|
MCULE-8721567365 |
0.82 |
[C@@]12(C)C(O)CC[C@@]1([H])[C@]1([C@@]([H])(C3CCC(C=C3CC1)=O)CC2)[H]
|
|
MCULE-3841271177 |
0.82 |
C12(C)C(O)CCC1([H])C1([H])C([H])(C3([H])CCC(C=C3CC1)=O)CC2
|
|
MCULE-3945869814 |
0.82 |
C12C(=O)C[C@H]([C@H](C)CCCC(C)C)[C@@]1(C)CCC1C=2CC[C@@]2([C@]1(C)CC[C@@H](O)C2)[H]
|
|
MCULE-2299251979 |
0.82 |
C[C@@]12CC[C@@]3([H])C([C@@H](O)[C@H](O)C[C@]3(C)[C@@]1([H])CC=C1[C@]3([H])CC(C)(C)CC[C@]3(C(=O)O)CC[C@@]21C)(C)C
|
|
MCULE-1591105974 |
0.82 |
C12(CO)CCC(CC1=CCC1C2CCC2(C1CCC2=O)C)O
|
|
MCULE-5063748511 |
0.82 |
C12CCC3=CC([C@H](C)CC3(C)C1CCC1(C)[C@](CCC21)(O)C)=O
|
|
MCULE-9131674305 |
0.82 |
O=C1CCC2(C)C3CCC4(C)C(CO)CCC4C3CCC2=C1
|
|
MCULE-1990275167 |
0.82 |
C12CCC3=C(CC)C(CCC3(C)C1CCC1(C)[C@](CCC21)(O)C)=O
|
|
MCULE-1065645853 |
0.82 |
[C@]12(C)CCC(C=C1CCC1C2CC[C@]2(C1CCC2(C)O)C)=O
|
|
MCULE-4464327459 |
0.82 |
C1C[C@]2(C)[C@@]3([H])CC[C@]4(C)[C@@H](O)CC[C@@]4([H])[C@]3([H])CCC2=CC1=O
|
|
MCULE-9036760572 |
0.82 |
[C@@H](O)(CCCCCC)CC=CCCCCCCCC(=O)O
|
|
MCULE-8991093142 |
0.82 |
OC(=O)CCCCCCC/C=C\C[C@H](O)CCCCCC
|
|
MCULE-9156595873 |
0.82 |
C(CCCCC)C(O)CC=CCCCCCCCC(=O)O
|
|
MCULE-3614931522 |
0.82 |
CC1([C@@]2([H])[C@]([C@@]3([C@](CC2)(C)[C@]2(C([C@]4([C@](CC2)(C(=O)O)CC[C@@H](C)[C@@H]4C)[H])=CC3)C)[H])(C)C[C@@H](O)[C@@H]1O)C
|
|
MCULE-5274452426 |
0.82 |
[C@]12(C)CCC(C=C1CC[C@]1([H])[C@]2([H])CC[C@]2([C@@]1([H])CC[C@]2(C)O)C)=O
|
|
MCULE-2675118265 |
0.82 |
C1[C@@]2([H])C3=CC[C@]4([H])[C@@]5(C)C[C@@H](O)[C@H](O)C(C)(C)[C@]5([H])CC[C@@]4(C)[C@]3(C)CC[C@@]2(C(O)=O)CCC1(C)C
|
|
MCULE-1660040884 |
0.82 |
C[C@]12CC[C@@]3([H])[C@](CCC4[C@]3(C)CCC(=O)C=4)([H])[C@]1([H])CC[C@@]2(O)C
|
|
MCULE-3946245376 |
0.82 |
C12(C)CCC(C=C1CCC1C2CCC2(C1CCC2(C)O)C)=O
|
|
MCULE-8155210029 |
0.82 |
C[C@]12CC[C@]3([H])[C@@]4(C)CC[C@H](O)CC4=CC[C@@]3([H])[C@]1([H])CC[C@@H]2C(=O)CO
|
|
MCULE-6301076627 |
0.82 |
[C@]12(C)CC[C@]3([C@@]([H])(CC=C4C[C@@H](O)CC[C@]34C)[C@]1([H])C[C@@H](C)[C@]2(O)C(C)=O)[H]
|
|
MCULE-9917637884 |
0.82 |
[C@]12(CO)CC[C@@H](CC1=CC[C@]1([H])C2CC[C@]2(C1CCC2=O)C)O
|
|
MCULE-8259872102 |
0.82 |
C(C)(C1C(O)CC2C1(C)CCC1C2CC=C2CC(O)CCC21C)=O
|
|
MCULE-1294118086 |
0.82 |
[C@]12(C)CCC(C=C1CC[C@]1([H])[C@]2([H])CC[C@]2([C@@]1([H])CC[C@@H]2O)C)=O
|
|
MCULE-6409888378 |
0.82 |
C1[C@]2([H])[C@@](C(O)=O)(CC[C@]3(C)C2=CC[C@@]2([H])[C@@]3(C)CC[C@]3([H])[C@]2(C)CC[C@H](O)[C@]3(CO)C)CCC1(C)C
|
|
MCULE-9071849084 |
0.82 |
C12(C)CCC3(C([H])(CC=C4CC(O)CCC34C)C1([H])CC(C)C2(O)C(C)=O)[H]
|
|
MCULE-7998597001 |
0.82 |
C[C@H]1[C@H]2[C@H]3[C@](C)(CC[C@@H]2[C@@H]2C(=CC(CC2)=O)C1)[C@](O)(C)CC3
|
|
MCULE-1780641937 |
0.82 |
C12=CC[C@]3([C@@](C)(CC[C@@]4([H])C([C@@H](O)[C@H](O)C[C@]34C)(C)C)[C@]1(C)CC[C@]1(CC[C@@H](C)[C@H](C)[C@@]21[H])C(O)=O)[H]
|
|
MCULE-1602610126 |
0.82 |
CC1C(C)C2C(C(O)=O)(CCC3(C)C4(C)CCC5C(C)(C)C(O)C(O)CC5(C)C4CC=C32)CC1
|
|
MCULE-7400696054 |
0.82 |
C12C3C4C5C1C=CC5C2C4C(C(O)=O)C3C(O)=O
|
|
MCULE-9211922250 |
0.82 |
C12[C@H]3[C@@](CCC(C)(C)C3)(C(O)=O)CC[C@]1(C)[C@@]1(C)CC[C@@H]3[C@@](C)(CC[C@H](O)[C@@]3(C)CO)[C@H]1CC=2
|
|
MCULE-3800481886 |
0.82 |
C1(C)(C)C[C@@]2([H])C3=CC[C@]4([H])[C@@]5(C)CC[C@H](O)[C@](CO)(C)[C@]5([H])CC[C@@]4(C)[C@]3(C)CC[C@@]2(C(O)=O)CC1
|
|
MCULE-5685325143 |
0.82 |
C12(C)CCC3(C([H])(CC=C4CC(O)CCC34C)C1([H])CCC2C(CO)=O)[H]
|
|
MCULE-3171016035 |
0.82 |
C1CCC2C(C(O)=O)C2C=CC1
|
|
MCULE-3333652397 |
0.82 |
C12(C)CCC(C=C1CCC1C2CCC2(C1CCC2O)C)=O
|
|
MCULE-1067283755 |
0.82 |
C1(O)CC2(C)C3CC=C4C5CC(C)(C)CCC5(C(O)=O)CCC4(C)C3(C)CCC2C(C)(C)C1O
|
|
MolPort-006-168-732 |
0.82 |
CCCCCCC(O)C\C=C\CCCCCCCC(O)=O
|
|
MolPort-035-683-013 |
0.82 |
OC(=O)C1C2CC\C=C/CC\C=C/CCC12
|
|
MolPort-003-939-239 |
0.82 |
CCCCCC[C@@H](O)C\C=C/CCCCCCCC(O)=O
|
|
MolPort-046-765-905 |
0.82 |
OC(=O)CCCCCCC\C=C/CC=O
|
|
MolPort-044-727-745 |
0.82 |
CCCCCC[C@@H](O)C\C=C\CCCCCCCC(O)=O
|
|
MolPort-002-134-879 |
0.82 |
OC(=O)C1C2CC\C=C\CC\C=C/CCC12
|
|
MolPort-046-790-501 |
0.81 |
CC1=C(C)[C@H]2C3=CC[C@@H]4[C@@]5(C)CC[C@H](O)C(C)(C)[C@@H]5CC[C@@]4(C)[C@]3(C)CC[C@]2(CC1)C(O)=O
|
|
MolPort-044-649-693 |
0.81 |
CC(=C)[C@@H]1CC[C@@]2(CC[C@]3(C)[C@H](CC[C@@H]4[C@@]5(C)C=C(O)C(=O)C(C)(C)[C@@H]5CC[C@@]34C)[C@@H]12)C(O)=O
|
|
MolPort-039-338-562 |
0.81 |
CC(C)C(=C)CC[C@H]([C@H]1CC[C@@]2(C)C3=CC[C@H]4C(C)(C)[C@@H](O)CC[C@]4(C)C3=CC[C@]12C)C(O)=O
|
|
MolPort-039-339-168 |
0.81 |
CC(C)=CCC[C@H]([C@H]1CC[C@@]2(C)C3=CC[C@H]4C(C)(C)[C@@H](O)CC[C@]4(C)C3=CC[C@]12C)C(O)=O
|
|
MolPort-021-804-809 |
0.81 |
CC1(CC2CCC3C(C)(CCCC3(C)C2=CC1=O)C(O)=O)C=C
|
|
MCULE-2016404995 |
0.81 |
C(O)(CC1(C)C(CC=C2C3CCC(C(C)C=CC(C)C(C)C)C3(C)CCC12)([H])C(O)=O)=O
|
|
MCULE-4786407254 |
0.81 |
C1CC2=C(C3(CCC(O)C(C(=O)O)C31)C)C(CC1(C(CCC21)C(O)C)C)O
|
|
MCULE-2832089707 |
0.81 |
C1CC2(C)C3=CC(=O)C(C)(C=C)CC3CCC2C(C(=O)O)(C)C1
|
|
MCULE-1068095495 |
0.81 |
OC1(CCC(=O)CC1)CC1CC=CC1
|
|
MCULE-6262778979 |
0.81 |
OC1(C(CC2CC=CC2)=O)CCCCC1
|
|
MCULE-4609643145 |
0.81 |
C12C(C)(C)CCCC=1CC(C(O)=O)C(C(O)=O)C2
|
|
MCULE-7472546811 |
0.81 |
C[C@]12CC[C@@]3([H])[C@]([C@@H](CC4[C@]3(C)CCC(=O)C=4)CCC)([H])[C@]1([H])CC[C@]2(O)CCC(=O)[O-]
|
|
MCULE-4280394560 |
0.81 |
C1C(=O)[C@]2(C)C3CC=C4[C@]5([H])CC(C)(C)CC[C@]5(C(=O)O)CC[C@@]4(C)[C@]3(C)CCC2[C@](C)(CO)[C@H]1O
|
|
MCULE-6793463685 |
0.81 |
O=C1CCC2(C)C(=C1)CCC1C(O)CCC(O)C21
|
|
MCULE-5701652206 |
0.81 |
C[C@]12CC[C@@]3([H])[C@]([C@@H](CC4[C@]3(C)CCC(=O)C=4)CCC)([H])[C@]1([H])CC[C@@]2(O)CCC(=O)[O-]
|
|
MCULE-4272187140 |
0.81 |
C1(CC(C)=CC(C)C1C(O)=O)C(O)=O
|
|
MCULE-1842199780 |
0.81 |
C1C[C@]2(C)C3CC[C@]4(C)[C@@]([H])([C@@H](CC[C@H](O)C(O)(C)C)C)CC[C@@]4(C)C=3C(=O)C[C@@]2([H])C(C)(C)[C@H]1O
|
|
MCULE-9151137367 |
0.81 |
O=C1CCC2(C)C3CCC4(C)C(CCC4(O)C3CCC2=C1)C(C)=O
|
|
MCULE-2011201542 |
0.81 |
[C@]12(C)CCC([C@H](C(O)=O)C1CCC2C(C)CCCC(C)C)[C@@]1(C)CCC=CC1=O
|
|
MCULE-5031139336 |
0.81 |
C12(C3C=CC1C(C3)C(O)=O)CC2
|
|
MCULE-9137191737 |
0.81 |
C1(C)(C)C=C(C)CC(C(O)=O)C1C(O)=O
|
|
MCULE-4874634113 |
0.81 |
C1(CCCC)(C(O)=O)CC(C)=C(CC1C(O)=O)C
|
|
MCULE-8052468805 |
0.81 |
C1C(CC)C(C(=O)O)C(C(=O)O)CC=1
|
|
MolPort-027-853-644 |
0.81 |
CC1(C)CC[C@@]2(CC[C@]3(C)C(=CCC4[C@@]3(C)CCC3[C@](C)(CO)[C@@H](O)CC(=O)[C@]43C)[C@@H]2C1)C(O)=O
|
|
MolPort-002-841-842 |
0.81 |
CC(C)CCCC(C)C1CCC2[C@H](C(CC[C@]12C)[C@@]1(C)CCC=CC1=O)C(O)=O
|
|
MolPort-000-832-360 |
0.81 |
CC1(C)CCCC2=C1CC(C(C2)C(O)=O)C(O)=O
|
|
MolPort-002-130-596 |
0.81 |
CC1=CC(C)(C)C(C(C1)C(O)=O)C(O)=O
|
|
MolPort-002-114-330 |
0.81 |
CC1C=C(C)CC(C1C(O)=O)C(O)=O
|
|
MolPort-002-159-548 |
0.81 |
CCCCC1(CC(C)=C(C)CC1C(O)=O)C(O)=O
|
|
MolPort-002-017-775 |
0.81 |
OC(=O)C1CC2C=CC1C21CC1
|
|
MolPort-003-941-070 |
0.80 |
CCCCCC(=O)CC[C@H]1[C@H](O)C[C@H](O)[C@@H]1C\C=C/CCCC(O)=O
|
|
MolPort-006-129-942 |
0.80 |
CC1(C)CC[C@@]2([C@H](O)C[C@]3(C)C(=CC[C@@H]4[C@@]5(C)CC[C@H](O)[C@@](C)(CO)[C@@H]5CC[C@@]34C)[C@@H]2C1)C(O)=O
|
|
MolPort-035-706-198 |
0.80 |
CC(C)[C@@H]1[C@H](O)C[C@@H](C)[C@@H]2CC(=O)C(C)=C[C@H]12
|
|
MolPort-005-934-866 |
0.80 |
C[C@H]1C[C@H]2[C@@H]3CC[C@](O)(C(C)=O)[C@@]3(C)CC[C@@H]2[C@@]2(C)CCC(=O)C=C12
|
|
MolPort-039-338-358 |
0.80 |
CC1(C)CC[C@@]2(CC[C@]3(C)C(=CC[C@@H]4[C@@]5(C)CC[C@@H](O)[C@](C)([C@@H]5CC[C@@]34C)C(O)=O)[C@@H]2C1)C(O)=O
|
|
MolPort-009-018-301 |
0.80 |
CCCCCC(=O)CC[C@@H]1C(C\C=C/CCCC(O)=O)C(O)CC1=O
|
|
MolPort-046-153-751 |
0.80 |
CC1(C)CC[C@]2(C)CC[C@]3(C(O)=O)C(=CC[C@@H]4[C@@]5(C)CC[C@H](O)C(C)(C)[C@@H]5CC[C@@]34C)[C@@H]2C1
|
|
MolPort-035-681-549 |
0.80 |
C[C@H](O)[C@@]1(O)CC[C@H]2[C@@H]3CCC4=CC(=O)CC[C@]4(C)[C@H]3CC[C@]12C
|
|
MolPort-005-938-470 |
0.80 |
CC(=O)[C@@]1(O)CCC2C3CCC4=CC(=O)CCC4(C)C3CCC12C
|
|
MolPort-028-754-125 |
0.80 |
CC1(C)CC[C@@]2(CC[C@]3(C)[C@H](CC[C@@H]4[C@@]5(C)CCC(=O)C(C)(C)[C@@H]5CC[C@@]34C)C2=C1)C(O)=O
|
|
MolPort-008-155-613 |
0.80 |
CC(=O)[C@@]1(O)CCC2C3CCC4=CC(=O)CCC4C3CCC12C
|
|
MolPort-019-857-808 |
0.80 |
CC12CCC3C(C)(CCC4=CC(=O)CCC34C)C1CCC2C(=O)CO
|
|
MolPort-005-945-648 |
0.80 |
CC(C)[C@@H]1[C@@H](O)C[C@@H](C)[C@@H]2CC(=O)C(C)=C[C@H]12
|
|
MolPort-006-394-855 |
0.80 |
[2H]C([2H])([2H])[C@H]1C[C@H]2[C@@H]3CC[C@](O)(C(C)=O)[C@@]3(C)CC[C@@H]2[C@@]2(C)CCC(=O)C=C12
|
|
MolPort-019-937-248 |
0.80 |
CC1(C)CC[C@@]2([C@H](O)C[C@]3(C)C(=CCC4[C@@]5(C)CC[C@H](O)[C@](C)(C5CC[C@@]34C)C(O)=O)C2C1)C(O)=O
|
|
MolPort-039-141-884 |
0.80 |
C[C@@H]1CC(=O)C=C(C)[C@]11CC[C@H](C1)[C@](C)(O)CO
|
|
MolPort-039-141-882 |
0.80 |
C[C@@H]1CC(=O)C=C(C)[C@]11CC[C@H](C1)[C@@](C)(O)CO
|
|
MolPort-019-940-199 |
0.80 |
CC(=O)C1(O)CCC2C3CCC4=CC(=O)CCC4(C)C3CCC12C
|
|
MolPort-039-139-158 |
0.80 |
CCCCC[C@@H](O)\C=C\[C@H]1C[C@H]2C[C@@H]([C@@H]1C\C=C/CCCC(O)=O)C2(C)C
|
|
MolPort-039-138-901 |
0.80 |
C[C@@H](O)[C@@]1(O)CC[C@H]2[C@@H]3CCC4=CC(=O)CC[C@]4(C)[C@H]3CC[C@]12C
|
|
MolPort-021-783-103 |
0.80 |
CCCCCCCC(=O)CC[C@H]1[C@H](O)C[C@H](O)[C@@H]1C\C=C/CCCC(O)=O
|
|
MolPort-027-835-865 |
0.80 |
CC(=O)[C@@]1(O)CC[C@H]2[C@@H]3CCC4=CC(=O)CC[C@@H]4[C@H]3CC[C@]12C
|
|
MolPort-006-111-539 |
0.80 |
CC1(C)CC[C@@]2([C@H](O)C[C@]3(C)C(=CC[C@@H]4[C@@]5(C)CC[C@H](O)C(C)(C)[C@@H]5CC[C@@]34C)[C@@H]2C1)C(O)=O
|
|
MolPort-027-640-987 |
0.80 |
CCCCC[C@H](O)\C=C\[C@H]1C[C@H]2C[C@H](C2)[C@@H]1C\C=C/CCCC(O)=O
|
|
MolPort-027-640-923 |
0.80 |
CCCCCC(=O)CC[C@H]1[C@H](O)C[C@H](O)[C@H]1C\C=C/CCCC(O)=O
|
|
MolPort-006-112-162 |
0.80 |
CC1(C)CC[C@@]2([C@H](O)C[C@]3(C)C(=CC[C@@H]4[C@@]5(C)CC[C@H](O)[C@@](C)(C=O)[C@@H]5CC[C@@]34C)[C@@H]2C1)C(O)=O
|
|
MolPort-004-964-448 |
0.80 |
CCCCCC(=O)CC[C@H]1[C@H](O)CC(=O)[C@@H]1C\C=C/CCCC(O)=O
|
|
MolPort-003-959-213 |
0.80 |
CCCCC[C@H](O)\C=C\[C@H]1C[C@H]2C[C@@H]([C@@H]1C\C=C/CCCC(O)=O)C2(C)C
|
|
MolPort-046-594-086 |
0.80 |
CC1(C)CC[C@@]2([C@H](O)C[C@]3(C)C(=CC[C@@H]4[C@@]5(C)CC[C@H](O)C(C)(C)C5CC[C@@]34C)[C@H]2C1)C(O)=O
|
|
MolPort-002-530-358 |
0.80 |
C[C@]12CC[C@H]3[C@@H](CCC4=CC(=O)CC[C@]34C)[C@@H]1CC[C@@H]2C(=O)CO
|
|
MolPort-046-690-133 |
0.80 |
[2H]C1=C2C([2H])([2H])C[C@H]3[C@@H]4CC[C@](O)(C(=O)C([2H])([2H])[2H])[C@@]4(C)CC[C@@H]3[C@@]2(C)CC([2H])([2H])C1=O
|
|
MolPort-046-764-826 |
0.80 |
[2H]C1=C2C([2H])([2H])C[C@@H]3[C@@H]4CC[C@H](C(=O)C([2H])([2H])O)[C@@]4(C)CC[C@H]3[C@@]2(C)CC([2H])([2H])C1=O
|
|
MolPort-000-739-076 |
0.80 |
C[C@H]1CC2C3CC[C@](O)(C(C)=O)C3(C)CCC2C2(C)CCC(=O)C=C12
|
|
MolPort-000-738-106 |
0.80 |
CC12CC[C@H]3[C@@H](CCC4=CC(=O)CCC34C)[C@@H]1CC[C@@H]2C(=O)CO
|
|
MolPort-046-690-137 |
0.80 |
CC(=O)[C@H]1[C@H](O)C[C@H]2[C@@H]3CCC4=CC(=O)CC[C@]4(C)[C@H]3CC[C@]12C
|
|
MolPort-046-596-275 |
0.80 |
C[C@H]1CC2C3CC[C@](O)(C(C)=O)[C@@]3(C)CCC2[C@@]2(C)CCC(=O)C=C12
|
|
MolPort-002-507-146 |
0.80 |
CC(=O)[C@@]1(O)CC[C@H]2[C@@H]3CCC4=CC(=O)CC[C@]4(C)[C@H]3CC[C@]12C
|
|
MolPort-046-158-502 |
0.80 |
CC1(C)CC[C@@]2(CC[C@]3(C)[C@H](CC[C@@H]4[C@@]5(C)CC[C@H](O)C(C)(C)[C@@H]5CC[C@@]34C)C2=C1)C(O)=O
|
|
MolPort-002-507-411 |
0.80 |
C[C@]12CCC3C(CCC4=CC(=O)CC[C@]34C)C1CC[C@@]2(O)C=C
|
|
MolPort-002-526-228 |
0.80 |
C[C@H]1C[C@H]2C3CC[C@](O)(C(C)=O)[C@@]3(C)CCC2[C@@]2(C)CCC(=O)C=C12
|
|
MolPort-001-837-773 |
0.80 |
CC12CCC3C(CCC4=CC(=O)CCC34C)C1CCC2(O)C=C
|
|
MolPort-046-793-264 |
0.80 |
CC(=O)[C@]1(O)CC[C@H]2[C@@H]3CCC4=CC(=O)CC[C@]4(C)C3CC[C@@]12C
|
|
MolPort-002-510-661 |
0.80 |
CC(=O)[C@@]1(O)CCC2[C@@H]3CCC4=CC(=O)CC[C@]4(C)C3CC[C@]12C
|
|
MolPort-046-763-158 |
0.80 |
CCCCC[C@H](O)\C=C\[C@H]1CC2CC(C2)[C@@H]1C\C=C/CCCC(O)=O
|
|
MCULE-7057445911 |
0.80 |
C12C(C=CC1)C2C(O)=O
|
|
MCULE-1566569432 |
0.80 |
[C@]12(C)CCC(C=C1C(=O)CC1C3[C@@](C)([C@@](CC3)(CC)O)CCC12)=O
|
|
MCULE-1785744667 |
0.80 |
C1(C[C@@]2([H])[C@H](C)C[C@H](O)[C@H]([C@@]2([H])C=C1C)C(C)C)=O
|
|
MCULE-4023009546 |
0.80 |
C([C@]12CCC(C)(C)C[C@@]1([H])C1=CC[C@]3([H])[C@]4(CC[C@H](O)[C@@](C)(C=O)[C@]4([H])CC[C@@]3(C)[C@]1(C)C[C@H]2O)C)(=O)O
|
|
MCULE-9949303370 |
0.80 |
C(CO)(C1(O)CCC2C1(C)CCC1C2CC=C2CC(O)CCC21C)=O
|
|
MCULE-8934502311 |
0.80 |
C1(=O)CCC2(C)C3CCC4(C)C(C(CO)=O)CCC4C3(C)CCC2=C1
|
|
MCULE-2147959975 |
0.80 |
C1[C@@]2(C)C(CC[C@@H]3[C@@H]2CC[C@@]2(C)[C@H]3CC[C@]2(O)C(C)=O)=CC(=O)C1
|
|
MCULE-1251158415 |
0.80 |
[C@@]12([H])CC[C@](O)(C(=O)C)[C@@]1(C)CC[C@]1([H])[C@@]3([H])CCC(=O)C=C3CC[C@@]21[H]
|
|
MCULE-8509022096 |
0.80 |
[C@]12(C)[C@@]([H])(CC[C@@]3(C)[C@@]4(C)C([C@@]5([H])[C@](C(=O)O)(CCC(C)(C)C5)[C@H](O)C4)=CC[C@]13[H])[C@](C)(C=O)[C@@H](O)CC2
|
|
MCULE-7400247321 |
0.80 |
C12C=CC(C)C1C2C(O)=O
|
|
MCULE-4839802180 |
0.80 |
[C@@]12([H])CC[C@H](C(=O)CO)[C@@]1(C)CC[C@]1([H])[C@@]3(C)CCC(=O)C=C3CC[C@@]21[H]
|
|
MCULE-8997971805 |
0.80 |
[C@]12(C)CCC(C=C1C(=O)CC1C3[C@@](C)([C@@](CC3)(C)O)CCC12)=O
|
|
MCULE-4841780318 |
0.80 |
C1CC23CC=CCC2(C(O)C(=O)C3)CC=1
|
|
MCULE-2374686913 |
0.80 |
C1C[C@]2(C)[C@@]3([H])CC=C4[C@]5([H])CC(C)(C)CC[C@]5(C(O)=O)[C@H](O)C[C@@]4(C)[C@]3(C)CC[C@@]2([H])C(C)(C)[C@H]1O
|
|
MCULE-4949013565 |
0.80 |
C(C1(C2=CCCCC2)CCCCC1)(O)=O
|
|
MCULE-1412596642 |
0.80 |
[C@]12(C)CC[C@]3([C@@]([H])(CCC4=CC(=O)CC[C@]34C)[C@]1([H])CC[C@]2(O)C(C)=O)[H]
|
|
MCULE-7591106214 |
0.80 |
C1C(=O)C=C(C)[C@]2(CC[C@@]([H])([C@](O)(CO)C)C2)[C@@H]1C
|
|
MCULE-6199732071 |
0.80 |
C1(=O)C[C@@]2([H])[C@H](C)C[C@@H](O)[C@@H](C(C)C)[C@@]2([H])C=C1C
|
|
MCULE-5560129850 |
0.80 |
C1C(=O)C=C(C)[C@]2(CC[C@@]([H])([C@@](O)(CO)C)C2)[C@@H]1C
|
|
MCULE-6334133550 |
0.80 |
C1CC([H])(CC(OC)=O)C([H])(CC(OC)=O)CC=1
|
|
MCULE-3688392585 |
0.80 |
O=C1C(O)CC2C1(C)CCC1C2CC=C2CC(O)CCC21C
|
|
MCULE-3135517908 |
0.80 |
C12(C)CCC3C(CCC4=CC(=O)CCC34C)C1CCC2(O)C(C)=O
|
|
MCULE-8197236760 |
0.80 |
CC12CCC3([H])C4(CCC(=O)C=C4C(C)CC3([H])C1([H])CCC2(O)C(=O)C)C
|
|
MCULE-3390693428 |
0.80 |
C12(C)CCC3C(C)(CCC(=O)C=3)C1(C)CCC1(C)C(CCC21C)C(CO)=O
|
|
MCULE-6305022030 |
0.80 |
C[C@]12CC[C@]3([H])[C@]4(CCC(=O)C=C4[C@@H](C)C[C@@]3([H])[C@]1([H])CC[C@]2(O)C(=O)C)C
|
|
MCULE-4728366427 |
0.80 |
[C@]12(C)CC[C@]3([C@@]([H])(CCC4=CC(=O)CC[C@]34C)[C@]1([H])CC[C@@H]2C(CO)=O)[H]
|
|
MCULE-6552675485 |
0.80 |
C12(C)CCC(C=C1[C@H](CC1C3C(C)([C@@](CC3)(O)C(C)=O)CCC12)C)=O
|
|
MCULE-5054990207 |
0.80 |
C12(C)CCC3C(CCC4=CC(=O)CCC34C)C1CCC2C(CO)=O
|
|
MCULE-9123998949 |
0.80 |
C1CC(CC(OC)=O)(C)C(CC(OC)=O)(C)CC=1
|
|
MCULE-7490068037 |
0.80 |
C1(=C)C2CCCC1CC(C(O)=O)C2
|
|
MCULE-3259621922 |
0.80 |
C(O)(CC1CCCC(=C)C1)=O
|
|
MCULE-1939531919 |
0.80 |
CC1CC(C(O)=O)(C2C=CCCC2)C1
|
|
MCULE-3455137708 |
0.80 |
C(O)(CC(C)CC/C=C(/C)\C)=O
|
|
MCULE-1881964892 |
0.80 |
C(CCCC=CCCCC(O)=O)(O)=O
|
|
MCULE-7708235386 |
0.80 |
OC(C1(CC=CC1)CC1CC=CCC1)=O
|
|
MCULE-9520777832 |
0.80 |
C(O)(=O)C1CCC(CC1)=C
|
|
MCULE-1438242882 |
0.80 |
C(O)(=O)C[C@@](CC/C=C(/C)\C)(C)[H]
|
|
MCULE-8494008475 |
0.80 |
C1CC2(C)C3CCC4(C)C(C(CC/C=C(\C)/C(=O)O)C(O)=O)CCC4(C)C=3CCC2C(C)(C)C1=O
|
|
MCULE-1049317957 |
0.80 |
[C@@H]1(O)C[C@]2(C)[C@@]3([H])CC=C4[C@]5([H])[C@@H](C)C(=C)CC[C@]5(C(=O)O)CC[C@@]4(C)[C@]3(C)CC[C@@]2([H])[C@@](CO)(C)[C@H]1O
|
|
MCULE-9248944569 |
0.80 |
C1C[C@]2(C([C@@](C1)(C(O)=O)C)CC(=O)C1=C2CC[C@](C)(C=C)C1)C
|
|
MCULE-9416273604 |
0.80 |
CC1(CC[C@@]2(C(=O)O)[C@H](C3=C(CC2)[C@@]2(CC[C@H]4[C@@](C(=O)O)(C)[C@@H](O)[C@@H](O)C[C@]4(C)[C@H]2CC3)C)C1)C
|
|
MCULE-7221302841 |
0.80 |
CC1(C)CC2C(C(O)=O)(CCC3C4(C)CCC5C(C(O)=O)(C)C(O)C(O)CC5(C)C4CCC=32)CC1
|
|
MCULE-9358355806 |
0.80 |
C1=CCC23CCCCC2(C3(C(OC)=O)[H])C1
|
|
MCULE-9966885116 |
0.80 |
[C@@H]1(O)CC2(C3CC=C4C5C(C)C(=C)CCC5(C(O)=O)CCC4(C)C3(C)CCC2C(CO)(C)[C@H]1O)C
|
|
MolPort-001-792-025 |
0.80 |
CC(CCC=C(C)C)CC(O)=O
|
|
MolPort-002-687-552 |
0.80 |
OC(=O)CCC\C=C/CCCC(O)=O
|
|
MolPort-009-196-248 |
0.80 |
OC(=O)C1CCC(=C)CC1
|
|
MolPort-003-930-561 |
0.80 |
C[C@H](CCC=C(C)C)CC(O)=O
|
|
MolPort-019-936-866 |
0.80 |
C\C(=C/CCC(CO)C1CCC2(C)C3=C(CCC12C)C1(C)CCC(=O)C(C)(C)C1CC3)C(O)=O
|
|
MolPort-019-936-771 |
0.80 |
C\C(=C/CCC(C1CCC2(C)C3=C(CCC12C)C1(C)CCC(=O)C(C)(C)C1CC3)C(O)=O)C(O)=O
|
|
MolPort-001-740-973 |
0.80 |
C[C@@]1(CCC2=C(C1)C(=O)CC1[C@@](C)(CCC[C@]21C)C(O)=O)C=C
|
|
MolPort-046-594-247 |
0.80 |
CC1(C)CCC2(CCC3=C(CCC4C5(C)CC(O)C(O)C(C)(C5CCC34C)C(O)=O)C2C1)C(O)=O
|
|
MolPort-039-338-865 |
0.80 |
CC1(C)CC[C@@]2(CCC3=C(CC[C@@H]4[C@@]5(C)C[C@H](O)[C@H](O)[C@](C)([C@@H]5CC[C@@]34C)C(O)=O)[C@@H]2C1)C(O)=O
|
|
MolPort-028-610-006 |
0.80 |
CC1C2C3=CCC4C5(C)C[C@@H](O)[C@H](O)C(C)(CO)C5CCC4(C)C3(C)CCC2(CCC1=C)C(O)=O
|
|
MolPort-035-706-461 |
0.80 |
C[C@@H]1[C@H]2C3=CC[C@@H]4[C@@]5(C)C[C@@H](O)[C@H](O)[C@@](C)(CO)[C@@H]5CC[C@@]4(C)[C@]3(C)CC[C@]2(CCC1=C)C(O)=O
|
|
MolPort-027-641-365 |
0.79 |
[2H]\C(CCCCC)=C(/[2H])C\C([2H])=C(\[2H])C\C([2H])=C(\[2H])CCCCCCC(O)=O
|
|
MolPort-035-882-164 |
0.79 |
CCCCC\C=C/C\C=C/CCCCCCCCCCCC(O)=O
|
|
MolPort-001-780-227 |
0.79 |
CCCCC\C=C\C\C=C\CCCCCCCC(O)=O
|
|
MolPort-027-641-391 |
0.79 |
[2H]\C(CCCCCCCC)=C(/[2H])C\C([2H])=C(\[2H])C\C([2H])=C(\[2H])CCCC(O)=O
|
|
MolPort-003-933-184 |
0.79 |
CCCCC\C=C/C\C=C/C\C=C/CCCCCCC(O)=O
|
|
MolPort-003-941-261 |
0.79 |
CCCCC\C=C\C\C=C\CCCCCCCCCC(O)=O
|
|
MolPort-009-018-831 |
0.79 |
OCCCCC\C=C/C\C=C/C\C=C/C\C=C/CCCC(O)=O
|
|
MolPort-009-018-939 |
0.79 |
[2H]C([2H])([2H])C([2H])([2H])\C=C/C\C=C/C\C=C/C\C=C/C\C=C/CCCCCC(O)=O
|
|
MolPort-022-366-437 |
0.79 |
OC(=O)CC1CCCC=C1
|
|
MolPort-001-742-271 |
0.79 |
C\C(CC[C@H]1[C@](C)(O)CCC2[C@]1(C)CCC[C@]2(C)C(O)=O)=C\CO
|
|
MolPort-044-727-764 |
0.79 |
CCCCC\C=C/C\C=C/CCCCCCCCCCC(O)=O
|
|
MolPort-003-941-054 |
0.79 |
CCCCC\C=C/C\C=C/C\C=C/C\C=C/CCCCCC(O)=O
|
|
MolPort-044-724-154 |
0.79 |
CCCCCC=CCC=CCCCCCCCC(O)=O
|
|
MolPort-003-937-817 |
0.79 |
CC\C=C/C\C=C/C\C=C/CCCCCCCC(O)=O
|
|
MolPort-003-940-987 |
0.79 |
CC\C=C/C\C=C/C\C=C/C\C=C/C\C=C/CCCCCC(O)=O
|
|
MolPort-001-788-459 |
0.79 |
CCCCC\C=C/C\C=C/CCCCCCCC(O)=O
|
|
MolPort-046-683-522 |
0.79 |
CCCCC\C=C\C\C=C\C\C=C\C\C=C/CCCCCC(O)=O
|
|
MolPort-006-113-817 |
0.79 |
CCC=CCC=CCC=CCCCCCCCC(O)=O
|
|
MolPort-001-740-230 |
0.79 |
CC\C=C/C\C=C/C\C=C/CCCCCCCCCCCC(O)=O
|
|
MolPort-039-339-172 |
0.79 |
C[C@@H]1CC[C@@]2(CC[C@]3(C)C(=CC(=O)[C@@H]4[C@@]5(C)CC[C@H](O)C(C)(C)[C@@H]5CC[C@@]34C)[C@@H]2[C@H]1C)C(O)=O
|
|
MolPort-046-508-998 |
0.79 |
CC(C)=CCC[C@H]([C@H]1[C@H](O)C[C@@]2(C)C3=C(CC[C@]12C)[C@@](C)(CCC(O)=O)[C@@H](CC3)C(C)=C)C(O)=O
|
|
MolPort-003-983-803 |
0.79 |
[K+].CCC[C@@H]1CC2=CC(=O)CC[C@]2(C)[C@H]2CC[C@@]3(C)[C@@H](CC[C@@]3(O)CCC([O-])=O)[C@H]12
|
|
MolPort-044-649-596 |
0.79 |
C[C@@H]1CC[C@@]2(CC[C@]3(C)C(=CC(=O)[C@@H]4[C@@]5(C)CCC(=O)C(C)(C)[C@@H]5CC[C@@]34C)[C@@H]2[C@H]1C)C(O)=O
|
|
MolPort-001-741-330 |
0.79 |
CC1(C)CC[C@@]2(CC[C@]3(C)C(=CCC4[C@@]5(C)C[C@@H](O)[C@H](O)[C@@](C)(CO)C5[C@H](O)C[C@@]34C)[C@@H]2C1)C(O)=O
|
|
MolPort-020-005-924 |
0.79 |
C[C@@H]1CC[C@@]2(CC[C@]3(C)C(=CCC4[C@@]5(C)C[C@@H](O)[C@H](O)[C@@](C)(CO)C5[C@H](O)C[C@@]34C)C2[C@H]1C)C(O)=O
|
|
MolPort-028-744-491 |
0.79 |
C[C@@H]1CC[C@@]2(CC[C@]3(C)C(=CC[C@@H]4[C@@]5(C)C[C@@H](O)[C@H](O)[C@@](C)(CO)[C@@H]5[C@H](O)C[C@@]34C)[C@@H]2[C@H]1C)C(O)=O
|
|
MolPort-039-009-099 |
0.79 |
CC(=O)C1(O)C(=C)CC2C3CCC4=CC(=O)CCC4(C)C3CCC12C
|
|
MolPort-044-193-687 |
0.79 |
CC1CCC2(CCC3(C)C(=CCC4C5(C)CC(O)C(O)C(C)(CO)C5C(O)CC34C)C2C1C)C(O)=O
|
|
MCULE-4653646367 |
0.79 |
C(CCCCCCCC=CCC=CCCCCC)(O)=O
|
|
MCULE-9405390567 |
0.79 |
C(CCCCCCC(=O)O)CC/C=C/C/C=C/CCCCC
|
|
MCULE-6594867113 |
0.79 |
CC/C=C\C/C=C\C/C=C\CCCCCCCC(=O)O
|
|
MCULE-1893075589 |
0.79 |
CCCCC/C=C\C/C=C\CCCCCCCC(=O)O
|
|
MCULE-8042162865 |
0.79 |
C(CCCCCCCC=CCC=CCC=CCC)(O)=O
|
|
MCULE-9671518710 |
0.79 |
C(CCCCCCC/C=C/C/C=C/CCCCC)(O)=O
|
|
MCULE-9082869288 |
0.79 |
CCCCC/C(/[H])=C(\[H])/C/C(/[H])=C(\[H])/C/C(/[H])=C(\[H])/C/C(/[H])=C(/[H])\CCCCCC(O)=O
|
|
MCULE-4209942909 |
0.79 |
C(/C=C\C/C=C\C/C=C\CC)CCCCCCCCCCC(=O)O
|
|
MCULE-1825456795 |
0.79 |
C(O)(=O)CCC/C=C\C/C=C\C/C=C\C/C=C\CCCCCO
|
|
MCULE-6424725551 |
0.79 |
C1C[C@@](C2CC[C@](C)([C@@H]([C@@]2(C)C1)CC/C(/C)=C\CO)O)(C(O)=O)C
|
|
MCULE-4522488137 |
0.79 |
[C@@H]1(O)C[C@]2(C)[C@@]3([H])CC=C4[C@]5([H])[C@@H](C)[C@H](C)CC[C@]5(C(=O)O)CC[C@@]4(C)[C@]3(C)C[C@@H](O)[C@@]2([H])[C@@](CO)(C)[C@H]1O
|
|
MCULE-5532688938 |
0.79 |
C12(C)CCC3C4(C)CCC(=O)C=C4CCC3C1CC(=C)C2(O)C(=O)C
|
|
MCULE-8193803152 |
0.79 |
CC1([C@H](CC[C@@]2(C3CC[C@@]4(C)[C@@](C)(CC[C@@H]4[C@@H](C(C/C=C(\C)/C)O)C)C=3C(=O)C[C@@]12[H])C)O)C
|
|
MCULE-3885425015 |
0.79 |
[C@H]1(C[C@@]2([C@@]3([H])CC=C4[C@]5([C@](CC[C@@]4(C)[C@]3(C)C[C@H]([C@@]2([H])[C@](CO)([C@H]1O)C)O)(C(=O)O)CC[C@@H](C)[C@@H]5C)[H])C)O
|
|
MCULE-6629316076 |
0.79 |
O=C1C(=CO)CC2C1(C)CCC1C2CC=C2CC(O)CCC21C
|
|
MCULE-8041079323 |
0.79 |
C[C@]12CC[C@@]3([H])[C@]([C@@H](CC4[C@]3(C)CCC(=O)C=4)CCC)([H])[C@]1([H])CC[C@]2(O)CCC(=O)[O-].[K+]
|
|
MCULE-2196052177 |
0.79 |
[K+].C[C@]12CC[C@@]3([H])[C@]([C@@H](CC4[C@]3(C)CCC(=O)C=4)CCC)([H])[C@]1([H])CC[C@@]2(O)CCC(=O)[O-]
|
|
MCULE-6829909415 |
0.79 |
C(C(=O)O)C[C@]1(C)C2CC[C@]3(C)[C@@]([H])([C@H](C(=O)O)CC/C=C(/C)\C)[C@H](O)C[C@@]3(C)C=2CC[C@@]1([H])C(=C)C
|
|
MCULE-6441405293 |
0.79 |
OC(C1(CC2C(C2)C1)CC1CC=CC1)=O
|
|
MCULE-1755461261 |
0.79 |
[C@]1(C)(CCC(=O)O)C2CC[C@]3([H])[C@@]([H])([C@@](O)(CC/C=C(\C)/C)C)CC[C@@]3(C)[C@]2(C)CC[C@H]1C(=C)C
|
|
MCULE-7053911643 |
0.79 |
C(O)(=O)CC1C(CC=CC)CC(C1)=O
|
|
MCULE-5436553655 |
0.79 |
[C@@H]1(O)C[C@@]2([C@@]3([H])CC=C4[C@]5([C@](C(O)=O)(CCC(C)(C)C5)CC[C@@]4(C)[C@]3(C)CC[C@@]2([H])[C@](C)(CO)[C@H]1O)[H])C
|
|
MCULE-3473010637 |
0.79 |
O=C1CCC2(C)C3C(O)CC4(C)CCCC4C3CCC2=C1
|
|
MCULE-5686534690 |
0.79 |
C12=CCC3C(C)(CCC4C3(C)CC(O)C(C4(C)CO)O)C1(C)CCC1(CCC(C)C(C)C21)C(O)=O
|
|
MCULE-1153477483 |
0.79 |
C1C[C@]2(C)[C@@]3([H])CC[C@]4(C)[C@@](O)(C(=O)CO)CC[C@@]4([H])[C@]3([H])CCC2=CC1=O
|
|
MCULE-8877595522 |
0.79 |
[C@]12(C)CC[C@]3([C@@]([H])(CCC4=CC(=O)CC[C@]34C)[C@]1([H])CC[C@]2(O)C(CO)=O)[H]
|
|
MCULE-9693195749 |
0.79 |
[C@@H]1(O)C[C@@]2(C3CC=C4C5CC(C)(C)CC[C@]5(C(O)=O)CC[C@@]4(C)[C@]3(C)CCC2[C@]([C@@H]1O)(C)CO)C
|
|
MCULE-4914143446 |
0.79 |
C1C[C@]2(C)C3CC[C@]4(C)[C@@]([H])([C@@H](CC[C@H](O)C(O)(C)C)C)CC[C@@]4(C)C=3C(=O)C[C@@]2([H])C(C)(C)C1=O
|
|
MCULE-4431659207 |
0.79 |
C1(O)CC2(C)C3CC=C4C5CC(C)(C)CCC5(C(=O)O)CCC4(C)C3(C)CCC2C(CO)(C)C1O
|
|
MCULE-9765892541 |
0.79 |
C12(C)CCC3C(CCC4=CC(=O)CCC34C)C1CCC2(O)C(CO)=O
|
|
MCULE-3724391729 |
0.79 |
C1(C(O)=O)CC(C)=C(CC1C(O)=O)C
|
|
MCULE-2458465887 |
0.79 |
O=C(OC)CCC(C)C1CCC2C1(C)C(O)CC1C2CCC2C=CCCC21C
|
|
MCULE-2999920945 |
0.79 |
C12(C)C(C(C)CCC(OC)=O)CCC1C1C(CC2)C2(CCCCC2C=C1)C
|
|
MCULE-1218384038 |
0.79 |
[C@@H]1(O)C[C@]2(C)[C@@]3([H])CC=C4[C@]5([H])[C@@H](C)[C@H](C)CC[C@]5(C(=O)O)CC[C@@]4(C)[C@]3(C)CC[C@@]2([H])[C@@](C)(CO)[C@H]1O
|
|
MCULE-9942267030 |
0.79 |
C12(C)CC=C(C(CCCC(C)C)C(O)=O)CC1CCC1C3C(C)(CCC21)C(O)CC3
|
|
MCULE-6147550234 |
0.79 |
[C@@H]1(C[C@@]2([C@@]3([H])CC=C4[C@@]5([H])[C@](CC[C@@]4(C)[C@]3(C)CC[C@@]2([H])[C@]([C@H]1O)(C)CO)(C(O)=O)CCC(C)(C)C5)C)O
|
|
MCULE-1509278335 |
0.79 |
[C@H]1(C(=C)C(=O)O)CC=C(CCC(=O)C)[C@@H](C)CC1
|
|
MCULE-8651982947 |
0.79 |
C(C)(C1(O)C(=C)CC2C1(C)CCC1C2CC=C2CC(O)CCC21C)=O
|
|
MCULE-2400907851 |
0.79 |
C12(C)CCC3C(CCC4=CC(=O)CCC34C)C1CC[C@]2(O)C(CO)=O
|
|
MCULE-5213682431 |
0.79 |
C1(C(O)=O)CC(C(C)C)=CCC1C(O)=O
|
|
MCULE-1389326170 |
0.79 |
[C@@H]1(O)C[C@]2(C)[C@@]3([H])CC=C4[C@]5([H])[C@@H](C)[C@H](C)CC[C@]5(C(O)=O)CC[C@@]4(C)[C@]3(C)CC[C@@]2([H])[C@@](C)(CO)[C@@H]1O
|
|
MCULE-5774214368 |
0.79 |
[C@@H]1(O)C[C@]2(C)[C@@]3([H])CC=C4[C@]5([H])[C@@H](C)[C@H](C)CC[C@]5(C(=O)O)CC[C@@]4(C)[C@]3(C)CC[C@@]2([H])[C@@](CO)(C)[C@H]1O
|
|
MCULE-1974040943 |
0.79 |
C12=CC[C@]3([C@@](C)(CC[C@]4([H])[C@]3(C)C[C@@H](O)[C@@H]([C@@]4(C)CO)O)[C@]1(C)CC[C@]1(CC[C@@H](C)[C@H](C)[C@@]21[H])C(O)=O)[H]
|
|
MCULE-2253127357 |
0.79 |
C1(CC(C)=CCC1C(O)=O)C(O)=O
|
|
MCULE-7925068743 |
0.79 |
[C@@H]1(O)C[C@]2(C)[C@@]3([H])CC=C4[C@]5([H])[C@@H](C)[C@H](C)CC[C@]5(C(=O)O)CC[C@@]4(C)[C@]3(C)CC[C@@]2([H])[C@@](CO)(C)[C@@H]1O
|
|
MCULE-8721851502 |
0.79 |
[C@@]12(C)C[C@@H](O)[C@@H]([C@](C)(CCC(C)(O)C=C)[C@@]1([H])CC(=O)C=C2C)C
|
|
MolPort-046-153-098 |
0.79 |
CC(C)=CCC[C@](C)(O)[C@H]1CC[C@]2(C)[C@@H]1CCC1[C@@](C)(CCC(O)=O)[C@@H](CC[C@@]21C)C(C)=C
|
|
MolPort-035-706-443 |
0.79 |
C[C@@H]1CC[C@@]2(CC[C@]3(C)C(=CC[C@@H]4[C@@]5(C)C[C@@H](O)[C@@H](O)[C@@](C)(CO)[C@@H]5CC[C@@]34C)[C@@H]2[C@H]1C)C(O)=O
|
|
MolPort-000-689-320 |
0.79 |
CC1=C(C)CC(C(C1)C(O)=O)C(O)=O
|
|
MolPort-001-741-005 |
0.79 |
CC1(C)CC[C@@]2(CC[C@]3(C)C(=CCC4[C@@]5(C)C[C@@H](O)[C@H](O)[C@@](C)(CO)C5CC[C@@]34C)C2C1)C(O)=O
|
|
MolPort-028-754-124 |
0.79 |
CC1(C)CC[C@@]2(CC[C@]3(C)C(=CC[C@@H]4[C@@]5(C)C[C@@H](O)[C@H](O)[C@@](C)(CO)[C@@H]5CC[C@@]34C)[C@@H]2C1)C(O)=O
|
|
MolPort-003-936-393 |
0.79 |
C[C@@H]1CC[C@@]2(CC[C@]3(C)C(=CCC4[C@@]5(C)C[C@@H](O)[C@H](O)[C@@](C)(CO)[C@@H]5CC[C@@]34C)[C@@H]2[C@H]1C)C(O)=O
|
|
MolPort-039-052-491 |
0.79 |
CC1(C)CC[C@@]2(CC[C@]3(C)C(=CC[C@@H]4[C@@]5(C)C[C@@H](O)[C@@H](O)[C@](C)(CO)[C@@H]5CC[C@@]34C)[C@@H]2C1)C(O)=O
|
|
MolPort-001-741-429 |
0.79 |
C[C@@H]1CC[C@@]2(CC[C@]3(C)C(=CCC4[C@@]5(C)C[C@@H](O)[C@H](O)[C@@](C)(CO)C5CC[C@@]34C)C2[C@H]1C)C(O)=O
|
|
MolPort-002-530-019 |
0.79 |
C[C@H]1[C@H](O)C[C@]2(C)[C@H](CC(=O)C=C2C)[C@]1(C)CCC(C)(O)C=C
|
|
MolPort-002-507-128 |
0.79 |
C[C@]12CC[C@H]3[C@@H](CCC4=CC(=O)CC[C@]34C)[C@@H]1CC[C@]2(O)C(=O)CO
|
|
MolPort-039-101-205 |
0.79 |
CC1(C)CCC2(CCC3(C)C(=CCC4C5(C)CC(O)C(O)C(C)(CO)C5CCC34C)C2C1)C(O)=O
|
|
MolPort-002-507-603 |
0.79 |
C[C@@H]1CC[C@@]2(CC[C@]3(C)C(=CCC4[C@@]5(C)C[C@@H](O)[C@@H](O)[C@@](C)(CO)C5CC[C@@]34C)[C@@H]2[C@H]1C)C(O)=O
|
|
MolPort-035-706-174 |
0.79 |
C[C@H]1CC[C@H](CC=C1CCC(C)=O)C(=C)C(O)=O
|
|
MolPort-002-130-595 |
0.79 |
CC(C)C1=CCC(C(C1)C(O)=O)C(O)=O
|
|
MolPort-002-516-984 |
0.79 |
C[C@H]1[C@H](O)C[C@]2(C)[C@H](CC(=O)C=C2C)[C@@]1(C)CCC(C)(O)C=C
|
|
MolPort-039-052-434 |
0.79 |
CC1(C)CC[C@@]2(CC[C@]3(C)C(=CC[C@@H]4[C@@]5(C)C[C@@H](O)[C@@H](O)[C@@](C)(CO)[C@@H]5CC[C@@]34C)[C@@H]2C1)C(O)=O
|
|
MolPort-002-709-805 |
0.79 |
CC12CCC3C(CCC4=CC(=O)CCC34C)C1CC[C@]2(O)C(=O)CO
|
|
MolPort-009-649-413 |
0.79 |
C[C@@H]1CC[C@@]2(CC[C@]3(C)C(=CC[C@@H]4[C@@]5(C)C[C@@H](O)[C@H](O)[C@@](C)(CO)[C@@H]5CC[C@@]34C)[C@@H]2[C@H]1C)C(O)=O
|
|
MolPort-035-706-441 |
0.79 |
C[C@@H]1CC[C@@]2(CC[C@]3(C)C(=CC[C@@H]4[C@@]5(C)C[C@@H](O)[C@H](O)[C@](C)(CO)[C@@H]5CC[C@@]34C)[C@@H]2[C@H]1C)C(O)=O
|
|
MolPort-002-134-098 |
0.79 |
CC1=CCC(C(C1)C(O)=O)C(O)=O
|
|
MolPort-005-938-499 |
0.79 |
CC1CCC2(CCC3(C)C(=CCC4C5(C)CC(O)C(O)C(C)(CO)C5CCC34C)C2C1C)C(O)=O
|
|
MolPort-005-944-681 |
0.79 |
CC1(C)CC[C@@]2(CC[C@]3(C)C(=CCC4[C@@]5(C)C[C@@H](O)[C@@H](O)[C@@](C)(CO)C5CC[C@@]34C)C2C1)C(O)=O
|
|
MolPort-046-761-837 |
0.79 |
C[C@@H]1CC[C@@]2(CC[C@]3(C)C(=CC[C@@H]4[C@@]5(C)C[C@@H](O)[C@H](O)[C@@](C)(CO)C5CC[C@@]34C)[C@@H]2[C@H]1C)C(O)=O
|
|
MolPort-020-006-013 |
0.79 |
CC1(C)CC[C@@]2(CC[C@]3(C)C(=CC[C@@H]4[C@@]5(C)C[C@H](O)[C@H](O)[C@@](C)(CO)[C@@H]5CC[C@@]34C)[C@@H]2C1)C(O)=O
|
|
MolPort-035-706-442 |
0.79 |
C[C@@H]1CC[C@@]2(CC[C@]3(C)C(=CC[C@@H]4[C@@]5(C)C[C@@H](O)[C@@H](O)[C@](C)(CO)[C@@H]5CC[C@@]34C)[C@@H]2[C@H]1C)C(O)=O
|
|
MolPort-027-640-938 |
0.78 |
CCCCC[C@H](O)CC[C@H]1[C@H](O)C[C@H](O)[C@@H]1C\C=C/CCCC(O)=O
|
|
MolPort-002-526-836 |
0.78 |
C[C@]12CCC3[C@@H](CCC4=C3CCC(=O)C4)C1CCC2O
|
|
MolPort-039-338-313 |
0.78 |
C[C@@]12CCC[C@](C)([C@H]1CC[C@@]13C[C@@H](CC[C@@H]21)C(CO)=C3)C(O)=O
|
|
MolPort-046-596-401 |
0.78 |
C[C@]12CCC3C(CCC4=C3CCC(=O)C4)C1CCC2O
|
|
MolPort-002-911-151 |
0.78 |
C[C@]1(O)CCC2C3CCC4=C(CCC(=O)C4)C3CCC12C
|
|
MolPort-035-706-269 |
0.78 |
C[C@@H](O)\C=C\[C@@]1(O)[C@H](C)CC(=O)CC1(C)C
|
|
MolPort-001-741-051 |
0.78 |
C[C@]12CCC[C@@](C)(C1CCC13CC(CCC21)C(CO)=C3)C(O)=O
|
|
MCULE-3553508294 |
0.78 |
OC(C1C(CC2CC=CC2)CC1)=O
|
|
MCULE-6884173238 |
0.78 |
CC1C(C(O)=O)(CC2CC=CC2)CCC1
|
|
MCULE-2896292130 |
0.78 |
OC(C1(CC1)CC1CC=CC1)=O
|
|
MCULE-3005532858 |
0.78 |
OC(C1(CCC1)CC1CC=CC1)=O
|
|
MCULE-4596209637 |
0.78 |
CC1CC(C(O)=O)(CC2CC=CC2)CC1
|
|
MCULE-6557448423 |
0.78 |
C12CC[C@@](O)(C)C1(C)CCC1C3CCC(=O)CC=3CCC21
|
|
MCULE-5683974067 |
0.78 |
C1C[C@]2(C([C@](C(O)=O)(C)C1)CCC13C2CCC(C(CO)=C1)C3)C
|
|
MCULE-8824898935 |
0.78 |
C(CC(C(C)C)/C=C/C(=C)CCC(=O)O)C(=O)C
|
|
MCULE-2125200193 |
0.78 |
[C@@]12(C)CC[C@]3([C@]([H])([C@H](C(C)=C)CC3)[C@@]1([H])CC[C@]1([H])[C@@]3([C@]([H])(C(C)(C)[C@H](CC3)O)CC[C@@]21C)C)C(O)=O
|
|
MCULE-5097841519 |
0.78 |
C1(=O)C([C@]2([C@](C)(CC1)[C@]1([H])[C@@]([C@]3([C@@](CC1)([H])[C@@]1([C@@](CC[C@H]1C(C)=C)(C(O)=O)CC3)[H])C)(C)CC2)[H])(C)C
|
|
MCULE-2871457061 |
0.78 |
C1C[C@]2(C)[C@@]3([H])CC[C@]4([H])[C@@]5([H])[C@H](C(C)=C)CC[C@@]5(CC[C@@]4(C)[C@]3(C)CC[C@@]2([H])C([C@@H]1O)(C)C)C(O)=O
|
|
MCULE-2255462467 |
0.78 |
C1C[C@]([C@@]2([C@](C1)(C)C1[C@]3(CC2)CC(=C)[C@@]([H])(C(=O)C=1)C3)[H])(C(O)=O)C
|
|
MCULE-9982252588 |
0.78 |
O=C(O)[C@]12[C@]([C@]3(CC[C@@]4([C@]5(CCC(=O)C(C)(C)[C@]5([H])CC[C@@]4(C)[C@]3(C)CC1)C)[H])[H])([H])[C@H](C(=C)C)CC2
|
|
MCULE-3066570238 |
0.78 |
C(O)(=O)[C@]12CC[C@@H](C(=C)C)[C@]1([H])[C@]1([H])[C@@]([C@]3([C@@](CC1)([H])[C@]1(C)[C@@](C([C@H](CC1)O)(C)C)([H])CC3)C)(C)CC2
|
|
MCULE-4487348024 |
0.78 |
[C@@]12(C)CCC3(C([C@H](C(C)=C)CC3)C1CCC1C2(C)CCC2C1(C)CCC(=O)C2(C)C)C(=O)[O-]
|
|
MCULE-8763282524 |
0.78 |
OC([C@@]12CC[C@@]3(C(O)=O)CCC(C(C)=C)C3[C@@]1([H])CCC1[C@@]2(C)CCC2[C@@]1(CC[C@H](O)C2(C)C)C)=O
|
|
MCULE-8322152301 |
0.78 |
CC(C1C2C3C(C)(CCC2(C(O)=O)CC1)C1(C)C(C2(C)C(CC1)C(C)(C)C(=O)CC2)CC3)=C
|
|
MCULE-8236621147 |
0.78 |
C12C3C(C)(CCC(C)(C(OC)=O)C3)CCC1(C)C1(C(C(=O)C=2)C2(C)CCC(C(C)(C)C2CC1)O)C
|
|
MCULE-2278067941 |
0.78 |
C12C3C(C)(CCC(C)(C(OC)=O)C3)CCC1(C)C1(C(C(=O)C=2)C2(C)CCC(C(C)(C)C2CC1)=O)C
|
|
MCULE-5368790248 |
0.78 |
C(O)(=O)[C@]12CC[C@@H](C(=C)C)[C@]1([H])[C@]1([H])[C@@]([C@]3([C@@](CC1)([H])[C@]1(C)[C@@](C([C@H](CC1)O)(C)C)([H])CC3)C)(C)CC2
|
|
MCULE-7030538659 |
0.78 |
C12(C(=O)O)C3C4C5C1C=CC5C2(C(=O)O)C4C=C3
|
|
MCULE-6242790082 |
0.78 |
C1CC2(C)C3CCC4(C)C(C(CC/C=C(\C)/C(=O)O)C)CCC4(C)C=3C(=O)CC2C(C)(C)C1O
|
|
MCULE-8721985369 |
0.78 |
OC(C1C2C(C(O)=O)C(C(O)=O)C(C=C2)C1C(O)=O)=O
|
|
MCULE-2275715129 |
0.78 |
C12(C)CCC3(C(C(C(C)=C)CC3)C1CCC1C2(C)CCC2C1(C)CCC(O)C2(C)C)C(O)=O
|
|
MCULE-9499600420 |
0.78 |
C12CC1C1C(C(O)=O)C(C(O)=O)C2C=C1
|
|
MCULE-6492075764 |
0.78 |
C1CC2(C(CC=1)(C(O)=O)CCCC2)CCC#N
|
|
MCULE-1720910553 |
0.78 |
[O-]C(=O)CCCCCCCC([H])=C([H])CC([H])=C([H])CCCCC.[Na+]
|
|
MCULE-2620645862 |
0.78 |
[O-]C(=O)CCCCCCCC=CCC=CCCCCC.[K+]
|
|
MCULE-4777198621 |
0.78 |
CCCCC/C=C\CCCCCC(C(=O)O)C(O)CC(=O)O
|
|
MCULE-7369936803 |
0.78 |
[C@H]1(CC=CCC)C(CC[C@@H]1CC(O)=O)=O
|
|
MCULE-2404322318 |
0.78 |
C(=O)(CC(O)C/C=C\CCCCCC)O
|
|
MolPort-019-997-682 |
0.78 |
CC(=C)[C@@H]1CC[C@@]2(CC[C@]3(C)[C@H](CC[C@@H]4[C@@]5(C)CCC(=O)C(C)(C)[C@@H]5CC[C@@]34C)[C@@H]12)C(O)=O
|
|
MolPort-005-273-812 |
0.78 |
OC(=O)C1C2C=CC(C1C(O)=O)C(C2C(O)=O)C(O)=O
|
|
MolPort-001-970-998 |
0.78 |
OC(=O)C1C2C=CC(C3CC23)C1C(O)=O
|
|
MolPort-039-338-234 |
0.78 |
C[C@]1(CCC[C@]2(C)[C@@H]1CC[C@@]13C[C@@H]([C@@H](O)C=C21)C(=C)C3)C(O)=O
|
|
MolPort-002-524-807 |
0.78 |
CC(=C)[C@@H]1CC[C@@]2(CC[C@]3(C)[C@H](CCC4[C@@]5(C)CC[C@@H](O)C(C)(C)C5CC[C@@]34C)C12)C(O)=O
|
|
MolPort-046-697-152 |
0.78 |
C[C@]1(CCC[C@]2(C)[C@@H]1CC[C@]13C[C@@H](C(=C)C1)C(=O)C=C23)C(O)=O
|
|
MolPort-001-960-404 |
0.78 |
COC(=O)C1(C)CCC2(C)CCC3(C)C(=CC(=O)C4C5(C)CCC(=O)C(C)(C)C5CCC34C)C2C1
|
|
MolPort-019-936-806 |
0.78 |
C[C@@H]1[C@H]2C3=CCC4[C@@]5(C)C[C@@H](O)[C@H](O)[C@@](C)(CO)C5[C@H](O)C[C@@]4(C)[C@]3(C)CC[C@]2(CCC1=C)C(O)=O
|
|
MolPort-001-960-400 |
0.78 |
COC(=O)C1(C)CCC2(C)CCC3(C)C(=CC(=O)C4C5(C)CCC(O)C(C)(C)C5CCC34C)C2C1
|
|
MolPort-046-596-331 |
0.78 |
COC(=O)[C@@]1(C)CC[C@]2(C)CC[C@]3(C)C(=CC(=O)C4[C@@]5(C)CCC(=O)C(C)(C)C5CC[C@@]34C)C2C1
|
|
MolPort-002-512-343 |
0.78 |
CC(=C)[C@@H]1CC[C@@]2(CC[C@]3(C)[C@H](CC[C@@H]4[C@@]5(C)CCC(=O)C(C)(C)C5CC[C@@]34C)C12)C(O)=O
|
|
MolPort-046-153-168 |
0.78 |
CC(CC\C=C(/C)C(O)=O)C1CCC2(C)C3=C(CCC12C)C1(C)CCC(O)C(C)(C)C1CC3=O
|
|
MolPort-035-706-378 |
0.78 |
CC(=C)[C@@H]1CC[C@@]2(CC[C@]3(C)[C@H](CC[C@@H]4[C@@]5(C)CC(=O)C(C)(C)[C@@H]5CC[C@@]34C)[C@@H]12)C(O)=O
|
|
MolPort-042-624-120 |
0.78 |
CC(=C)[C@@H]1CCC2(CC[C@]3(C)C(CCC4[C@@]5(C)CCC(=O)C(C)(C)C5CC[C@@]34C)C12)C(O)=O
|
|
MolPort-005-945-549 |
0.78 |
CC(=C)[C@@H]1CC[C@@]2(CC[C@@]3([C@H](CCC4[C@@]5(C)CCC(=O)C(C)(C)C5CC[C@@]34C)C12)C(O)=O)C(O)=O
|
|
MolPort-005-944-788 |
0.78 |
CC(=C)[C@H]1CC[C@@]2(CC[C@]3(C)C(CCC4[C@@]5(C)CCC(=O)C(C)(C)C5CC[C@@]34C)C12)C(O)=O
|
|
MolPort-002-527-360 |
0.78 |
COC(=O)[C@@]1(C)CC[C@]2(C)CC[C@]3(C)C(=CC(=O)C4[C@@]5(C)CCC(=O)C(C)(C)C5CC[C@@]34C)[C@@H]2C1
|
|
MolPort-005-944-694 |
0.78 |
CC(=C)C1CC[C@@]2(CC[C@@]3([C@H](CCC4[C@@]5(C)CC[C@H](O)C(C)(C)C5CC[C@@]34C)C12)C(O)=O)C(O)=O
|
|
MolPort-007-980-897 |
0.78 |
CC(=C)C1CCC2(CC[C@]3(C)C(CCC4[C@@]5(C)CCC(O)C(C)(C)C5CC[C@@]34C)C12)C(O)=O
|
|
MolPort-023-276-984 |
0.78 |
CC(=C)[C@@H]1CC[C@@]2(CC[C@]3(C)[C@H](CC[C@@H]4[C@@]5(C)CC[C@H](O)C(C)(C)[C@H]5CC[C@@]34C)[C@@H]12)C(O)=O
|
|
MolPort-007-980-886 |
0.78 |
COC(=O)[C@@]1(C)CC[C@]2(C)CC[C@]3(C)C(=CC(=O)C4[C@@]5(C)CCC(O)C(C)(C)C5CC[C@@]34C)[C@H]2C1
|
|
MolPort-039-033-337 |
0.78 |
CC(=C)[C@@H]1CC[C@@]2(CC[C@]3(C)C(CCC4[C@@]5(C)CC[C@H](O)C(C)(C)C5CC[C@@]34C)C12)C(O)=O
|
|
MolPort-046-426-986 |
0.78 |
CC(=C)C1CCC2(CCC3(C)C(CCC4C5(C)CCC(=O)C(C)(C)C5CCC34C)C12)C(O)=O
|
|
MolPort-002-525-704 |
0.78 |
COC(=O)[C@@]1(C)CC[C@]2(C)CC[C@]3(C)C(=CC(=O)C4[C@@]5(C)CC[C@H](O)C(C)(C)C5CC[C@@]34C)[C@H]2C1
|
|
MolPort-001-742-037 |
0.78 |
CC(=C)C1CC[C@@]2(CC[C@]3(C)C(CCC4[C@@]5(C)CC[C@@H](O)C(C)(C)C5CC[C@@]34C)C12)C(O)=O
|
|
MolPort-003-939-279 |
0.78 |
CC(=C)[C@@H]1CC[C@@]2(CC[C@]3(C)[C@H](CC[C@@H]4[C@@]5(C)CC[C@H](O)C(C)(C)[C@@H]5CC[C@@]34C)[C@@H]12)C(O)=O
|
|
MolPort-046-691-457 |
0.77 |
CC\C=C\CC1C(CC(O)=O)CCC1=O
|
|
MolPort-006-112-444 |
0.77 |
[Na+].CCCCC\C=C/C\C=C/CCCCCCCC([O-])=O
|
|
MolPort-044-637-555 |
0.77 |
CCCCCC\C=C/CC(O)CC(O)=O
|
|
MolPort-002-509-435 |
0.77 |
CC(=O)C1=CCC2[C@@H]3CC[C@H]4CC(O)CC[C@]4(C)[C@H]3CC[C@]12C
|
|
MolPort-044-727-658 |
0.77 |
[Na+].CC\C=C/C\C=C/C\C=C/CCCCCCCC([O-])=O
|
|
MolPort-002-525-755 |
0.77 |
CC(=O)C1=CCC2[C@@H]3CC[C@H]4C[C@H](O)CC[C@]4(C)C3CC[C@]12C
|
|
MolPort-002-506-866 |
0.77 |
CC(=O)C1=CC[C@H]2[C@@H]3CC[C@H]4C[C@@H](O)CC[C@]4(C)[C@H]3CC[C@]12C
|
|
MolPort-007-980-847 |
0.77 |
CC(=O)C1=CCC2C3CC[C@H]4C[C@H](O)CCC4(C)C3CCC12C
|
|
MolPort-044-727-656 |
0.77 |
[Na+].CC\C=C/C\C=C/C\C=C/C\C=C/C\C=C/CCCCCC([O-])=O
|
|
MolPort-003-941-834 |
0.77 |
CC\C=C/C[C@@H]1[C@@H](CC(O)=O)CCC1=O
|
|
MolPort-046-682-132 |
0.77 |
[Na+].CCCCC\C=C\C\C=C\CCCCCCCC([O-])=O
|
|
MolPort-005-944-881 |
0.77 |
C[C@@H]1CC[C@@]2(CC[C@]3(C)C(=CCC4[C@@]5(C)CC[C@H](O)C(C)(C)C5C(O)C[C@@]34C)[C@@H]2[C@]1(C)O)C(O)=O
|
|
MolPort-046-693-184 |
0.77 |
C[C@]12C[C@H](O)[C@H]3[C@@H](CCC4=CC(=O)CC[C@]34C)[C@@H]1CC[C@@H]2C(O)=O
|
|
MolPort-044-561-334 |
0.77 |
CC(C)CCC[C@@H](C)[C@H]1CC[C@H]2[C@H]3[C@H](CC[C@]12C)[C@@]1(C)CC[C@H](O)CC1=CC3=O
|
|
MolPort-006-394-318 |
0.77 |
CC(C)CCC[C@@H](C)[C@H]1CC[C@H]2[C@@H]3[C@H](O)CC4=CC(=O)CC[C@]4(C)[C@H]3CC[C@]12C
|
|
MolPort-006-066-916 |
0.77 |
OC(=O)C1[C@H]2C[C@@H](C=C2)[C@H]1C(O)=O
|
|
MolPort-046-689-970 |
0.77 |
CC(C)CCC[C@@H](C)[C@H]1CC[C@H]2[C@@H]3[C@@H](O)CC4=CC(=O)CC[C@]4(C)[C@H]3CC[C@]12C
|
|
MolPort-007-980-917 |
0.77 |
COC(=O)[C@]1(C)CCC[C@@]2(C)C1CCC13C=C(C(C)C)C(CC21)[C@@H]1[C@H]3C(=O)CCC1=O
|
|
MolPort-039-338-393 |
0.77 |
CC(=O)C1=CC[C@H]2[C@@H]3CCC4=CC(=O)CC[C@]4(C)[C@H]3C[C@@H](O)[C@]12C
|
|
MolPort-046-683-739 |
0.77 |
[2H]C([2H])([2H])C([2H])(CCC[C@@H](C)[C@H]1CC[C@H]2[C@H]3[C@H](CC[C@]12C)[C@@]1(C)CC[C@H](O)CC1=CC3=O)C([2H])([2H])[2H]
|
|
MolPort-046-690-063 |
0.77 |
[2H]C([2H])(CCC(C)CO)[C@@H](C)[C@@H]1C([2H])([2H])C[C@@H]2[C@@H]3[C@@H](CC[C@@]12C)[C@]1(C)CC[C@H](O)CC1=CC3=O
|
|
MolPort-002-508-355 |
0.77 |
CC(C)=CCCC1=CCC(C(C1)C(O)=O)C(O)=O
|
|
MolPort-002-800-179 |
0.77 |
CC1(C)CC(=O)C2=C(C1)CC1(C)CC(C)(C)CC2(O)C1
|
|
MolPort-002-513-837 |
0.77 |
CC(C)C1=CC23CCC4[C@](C)(CCC[C@@]4(C)C(O)=O)C2CC1C1C3C(=O)C=CC1=O
|
|
MolPort-000-142-104 |
0.77 |
OC(=O)C1C2CC(C=C2)C1C(O)=O
|
|
MolPort-027-947-880 |
0.77 |
OC(=O)[C@@H]1[C@H]2C[C@H](C=C2)[C@H]1C(O)=O
|
|
MolPort-002-514-171 |
0.77 |
COC(=O)[C@]1(C)CCC[C@@]2(C)C1CC[C@]13C=C(C(C)C)C(CC21)[C@@H]1[C@H]3C(=O)CCC1=O
|
|
MolPort-035-706-445 |
0.77 |
C[C@@H]1CC[C@@]2(CC[C@]3(C)C(=CC[C@@H]4[C@@]5(C)CCC(=O)C(C)(C)[C@@H]5[C@H](O)C[C@@]34C)[C@@H]2[C@]1(C)O)C(O)=O
|
|
MolPort-035-706-444 |
0.77 |
C[C@@H]1CC[C@@]2(CC[C@]3(C)C(=CC[C@@H]4[C@@]5(C)CC[C@H](O)C(C)(C)[C@@H]5[C@H](O)C[C@@]34C)[C@@H]2[C@]1(C)O)C(O)=O
|
|
MolPort-023-299-005 |
0.77 |
CC[C@@H](CC[C@@H](C)[C@H]1CC[C@H]2[C@H]3[C@H](CC[C@]12C)[C@@]1(C)CC[C@H](O)CC1=CC3=O)C(C)C
|
|
MolPort-023-298-994 |
0.77 |
CC(C)[C@@H](C)CC[C@@H](C)[C@H]1CC[C@H]2[C@H]3[C@H](CC[C@]12C)[C@@]1(C)CC[C@H](O)CC1=CC3=O
|
|
MolPort-002-525-628 |
0.77 |
CC(=O)[C@H]1C[C@H](O)C2[C@@H]3CCC4=CC(=O)CC[C@]4(C)C3C[C@@H](O)[C@]12C
|
|
MolPort-035-706-299 |
0.77 |
CC[C@H](CC[C@@H](C)[C@H]1CC[C@H]2[C@H]3[C@H](CC[C@]12C)[C@@]1(C)CC[C@H](O)CC1=CC3=O)C(C)C
|
|
MolPort-028-960-858 |
0.77 |
OC(=O)C1[C@H]2C[C@H](C=C2)C1C(O)=O
|
|
MolPort-001-783-149 |
0.77 |
OC(=O)[C@H]1C2CC(C=C2)[C@H]1C(O)=O
|
|
MolPort-046-761-519 |
0.77 |
CC(C)CCC[C@@H](C)[C@H]1CC[C@H]2C3[C@H](O)CC4=CC(=O)CC[C@]4(C)[C@H]3CC[C@]12C
|
|
MolPort-019-937-542 |
0.77 |
CC(CCC1(C)C(C)CCC2(C)C1CC(=O)C=C2C(O)=O)CC(O)=O
|
|
MolPort-019-937-543 |
0.77 |
CC(CCC1(C)C(C)CCC2(C)C1CC(O)C=C2C(O)=O)CC(O)=O
|
|
MolPort-046-761-514 |
0.77 |
[2H]C([2H])([2H])C([2H])(CCC[C@@H](C)[C@H]1CC[C@H]2C3[C@@H](O)CC4=CC(=O)CC[C@]4(C)[C@H]3CC[C@]12C)C([2H])([2H])[2H]
|
|
MolPort-003-801-798 |
0.77 |
C[C@]1(C2CC(C=C2)[C@@H]1C(O)=O)C(O)=O
|
|
MolPort-002-527-314 |
0.77 |
CC1(C)CC[C@]2(C)CC[C@]3(C)C4=C(CC[C@@]3(C)[C@@H]2C1)[C@@]1(C)CC[C@H](O)C(C)(C)C1CC4
|
|
MolPort-002-529-788 |
0.77 |
CC1(C)CC[C@]2(C)CC[C@]3(C)C4=C(CC[C@@]3(C)C2C1)[C@@]1(C)CCC(O)C(C)(C)C1CC4
|
|
MolPort-039-339-171 |
0.77 |
CC1(C)[C@@H](O)CC[C@@]2(C)[C@H]1CCC1=C2CC[C@@]2(C)[C@@H]3C[C@](C)(CO)CC[C@]3(C)CC[C@]12C
|
|
MCULE-9780635677 |
0.77 |
[C@@H]1(O)CC2[C@](C)(CC1)[C@]1([H])[C@]([H])([C@@]3([H])[C@@](CC1)(C)[C@@H]([C@H](C)CC[C@@H](C(C)C)CC)CC3)C(=O)C=2
|
|
MCULE-8464537126 |
0.77 |
CC12C(O)CCCC1=CC(=O)CC2
|
|
MCULE-4121463357 |
0.77 |
C1C[C@]2(C)[C@@]3([H])CC[C@]4(C)[C@@]([H])([C@@H](CC[C@H](C)C(C)C)C)CC[C@@]4([H])[C@]3([H])C(=O)C=C2C[C@H]1O
|
|
MCULE-8179123738 |
0.77 |
[C@@H]1(C(=O)O)[C@]2([H])C=C[C@@]([H])(C2)[C@H]1C(=O)O
|
|
MCULE-9798718462 |
0.77 |
[C@@H]12C[C@H]([C@@H](C(O)=O)[C@@H]1C(O)=O)C=C2
|
|
MCULE-1536126723 |
0.77 |
C(O)(C1C(C2C3(CCCC3)C1C=C2)C(O)=O)=O
|
|
MCULE-8919412541 |
0.77 |
C12CC(C(C(O)=O)C1C(O)=O)C=C2
|
|
MCULE-1585586063 |
0.77 |
C12C(CCC(=O)C=1)CC(C(O)=O)C2
|
|
MCULE-3632970812 |
0.77 |
O=C1CCC2(C)C3CCC4(C)C(CCC4(O)C3CCC2=C1)C(CO)=O
|
|
MCULE-9448141357 |
0.77 |
C12C(=O)CC(CC=1CC1(CC2(O)CC(C1)(C)C)C)(C)C
|
|
MCULE-8297407788 |
0.77 |
C1C[C@]2(C)[C@@]3([H])CC[C@]4(C)[C@@]([H])([C@@H](CC[C@@H](CC)C(C)C)C)CC[C@@]4([H])[C@]3([H])C(=O)C=C2C[C@H]1O
|
|
MCULE-7022735372 |
0.77 |
C1(=O)CC2C(C)(CCC(CC(O)=O)C)C(C)CCC2(C)C(C(O)=O)=C1
|
|
MCULE-8057091309 |
0.77 |
[C@@]1(C)(C(O)=O)[C@@H](C(O)=O)C2C=CC1C2
|
|
MCULE-9381861258 |
0.77 |
C1(O)CC2C(C)(CCC(CC(O)=O)C)C(C)CCC2(C)C(C(O)=O)=C1
|
|
MCULE-2390783905 |
0.77 |
[C@]12(C)[C@H](O)CC3[C@@]([H])(CCC4=CC(=O)CC[C@]34C)C1[C@H](C[C@@H]2C(C)=O)O
|
|
MCULE-8918435387 |
0.77 |
C(O)(C12CCC(O)CC1(O)CCC1C3=CCC(C3(C)CCC21)C(O)=O)=O
|
|
MCULE-3020606954 |
0.77 |
O=C1CC(C)(C)C2CC=CCC2C1(C)C
|
|
MCULE-5946438019 |
0.77 |
C[C@]12C3[C@@H]([C@@]4([C@@H](CC=3)C(C)(C)[C@H](O)CC4)C)CC[C@]1(C)[C@@H]1[C@@H](C)[C@H](C)CC[C@]1(C)CC2
|
|
MCULE-7023706443 |
0.77 |
C1C(O)C(C)(C)C2CC=CCC2(C)C1
|
|
MCULE-7199540909 |
0.77 |
O=C(C1CCCCC1)CC1CC=CCC1
|
|
MCULE-7214232871 |
0.77 |
C1C2=CCCC(C(C)C)C2CC(C=O)C1C
|
|
MCULE-2614181271 |
0.77 |
CC(C(CC1C2C=CC(CC2)C1)=O)(C)C
|
|
MCULE-5100609642 |
0.77 |
[C@]12(C)CC[C@@]3([C@@]([H])(CC(CC3)(C)C)[C@]1(C)CCC1[C@@]3(C(C(C)(C)[C@H](CC3)O)CCC2=1)C)C
|
|
MCULE-6215840629 |
0.77 |
[C@H]1(C(O)=O)CCC=CC1
|
|
MCULE-3541967763 |
0.77 |
[C@]12(CCC(=O)O)C[C@@]31CC[C@]1(C)[C@@]([H])([C@@H](CC/C=C(\C)/C)C)CC[C@@]1(C)[C@]3([H])CC[C@@]2([H])C(=C)CO
|
|
MCULE-6262725586 |
0.77 |
OC(C1CC=CCC1)=O
|
|
MCULE-9797420475 |
0.77 |
OC([C@H]1CC=CCC1)=O
|
|
MCULE-5009469360 |
0.77 |
[C@@H]1(C(O)=O)CCC=CC1
|
|
MCULE-1300466204 |
0.77 |
OC(=O)CC(O)C(C)C/C=C/CC(C)C(O)CC(=O)O
|
|
MCULE-5453524094 |
0.77 |
OC(C1CC(CC2CC=CC2)(O)C1)=O
|
|
MCULE-7139174666 |
0.77 |
C1CC(C(O)=O)(CC=C1)[H]
|
|
MCULE-1597942572 |
0.77 |
OC([C@@H]1CC=CCC1)=O
|
|
MCULE-7182736800 |
0.77 |
C(CC=CCCCC(O)=O)=CCC=CCC=CCCCCC
|
|
MCULE-7293878607 |
0.77 |
C(/C/C=C\CCCC(=O)O)=C/C/C=C\C/C=C\CCCCC
|
|
MCULE-8807729080 |
0.77 |
[C@]12([H])[C@@H](O)C[C@]3(C)C(CC[C@@]3([H])[C@]1([H])CCC1=CC(=O)CC[C@]21C)=O
|
|
MCULE-7329243914 |
0.77 |
C12(CO)CCC(C(C)(CCC(C)CC(O)=O)C1CCC=C2CO)C
|
|
MCULE-6588005387 |
0.77 |
[C@H]1(O)C[C@]2(C)[C@@]3([H])CC=C4[C@]5([C@]([C@@H](C[C@@]4(C)[C@]3(C)CC[C@@]2([H])[C@@](C)([C@H]1O)CO)O)(C(=O)O)CCC(C)(C)C5)[H]
|
|
MCULE-4690967590 |
0.77 |
C12(C)CCC(C=C1C(C)CC1([H])C3(C(C)(C(CC3)C(C)=O)CC(O)C21[H])[H])=O
|
|
MCULE-2991720663 |
0.77 |
C123C(C([H])(O)C1=O)(CC=CC2)CC=CC3
|
|
MCULE-2665091779 |
0.77 |
C12(CO)CCC3(C([H])(CCC4=CC(=O)CCC34C)C1([H])CCC2C(CO)=O)[H]
|
|
MCULE-7010605333 |
0.77 |
C1(=O)C=C2[C@](C)(CC1)[C@]1([H])[C@]([H])([C@@]3([H])[C@@](C[C@@H]1O)(C)[C@@H](C(=O)C)CC3)C[C@@H]2C
|
|
MCULE-2506206785 |
0.77 |
[C@@]12(C)C(=O)CCC1[C@]1(C([C@H](O)C2)[C@@]2(C)CCC(C=C2CC1)=O)[H]
|
|
MCULE-3600048668 |
0.77 |
[C@@]12(C)C[C@@H](O)[C@@]3([C@@]([H])(CC(CC3)(C)C)C1=CC[C@@]1([H])[C@@]2(C)CC[C@@]2([C@]1(C)C[C@@H]([C@H](O)[C@@]2(C)CO)O)[H])C(O)=O
|
|
MCULE-6482685801 |
0.77 |
C1CC2(C)C3C(=O)CC4(C)C(C(CCC(O)C(O)(C)C)C)CCC4(C)C=3C(=O)CC2C(C)(C)C1=O
|
|
MCULE-7688714216 |
0.77 |
O=C(O)[C@@]12[C@H](O)C[C@]3(C)C(=CC[C@]4([C@@]3(C)CC[C@]3([H])[C@@]4(C[C@@H]([C@@H](C3(CO)CO)O)O)C)[H])[C@]1([H])CC(C)(C)CC2
|
|
MCULE-4823405948 |
0.77 |
[C@]12([H])[C@@H](O)C[C@]3(C)C(CC[C@@]3([H])[C@]1([H])CCC1=CC(CC[C@]21C)=O)=O
|
|
MCULE-3069989292 |
0.77 |
[C@]12(C)CCC3[C@@]([H])(CC=C4C[C@@H](O)CC[C@]34C=O)C1CC[C@]2([H])[C@H](C)CCCC(C)C
|
|
MCULE-3556525470 |
0.77 |
C12(C)CCC3C(CC=C4CC(O)CCC34C)C1CC(C)=C2C(C)=O
|
|
MCULE-4586192863 |
0.77 |
O=C1CCC2(C)C3C(O)CC4(C)C(CCC4C3CCC2=C1)=O
|
|
MCULE-9656399480 |
0.77 |
C1C[C@]2(C)[C@@]3([H])CC[C@]4(C)C(=O)CC[C@@]4([H])[C@]3([H])CCC2=C(O)C1=O
|
|
MCULE-8925145429 |
0.77 |
O=C1CC[C@@]2([C@]3(CC[C@@]4(C(=O)CC[C@@]4([H])[C@]3([H])CCC2=C1O)C)[H])C
|
|
MolPort-044-561-075 |
0.77 |
CC\C=C/C\C=C/C\C=C/C\C=C/C\C=C/CCCCC(O)=O
|
|
MolPort-009-018-856 |
0.77 |
CC\C=C/C\C=C/C\C=C/C\C=C/CCCCC(O)=O
|
|
MolPort-006-728-041 |
0.77 |
OC(=O)[C@H]1CCC=CC1
|
|
MolPort-003-666-529 |
0.77 |
CCCCC\C=C/C\C=C/C\C=C/C\C=C/CCCC(O)=O
|
|
MolPort-042-675-273 |
0.77 |
CC(C\C=C\CC(C)C(O)CC(O)=O)C(O)CC(O)=O
|
|
MolPort-006-119-583 |
0.77 |
C[C@@H]1CC=CC[C@H]1C(O)=O
|
|
MolPort-009-018-907 |
0.77 |
[2H]\C(CCCCC)=C(/[2H])C\C([2H])=C(\[2H])C\C([2H])=C(\[2H])C\C([2H])=C(\[2H])CCCC(O)=O
|
|
MolPort-006-393-372 |
0.77 |
OC(=O)[C@@H]1CCC=CC1
|
|
MolPort-044-183-058 |
0.77 |
[2H]C([2H])([2H])C([2H])([2H])C([2H])([2H])C([2H])([2H])C([2H])([2H])\C=C/C\C=C/C\C=C/C\C=C/CCCC(O)=O
|
|
MolPort-006-169-802 |
0.77 |
CCCCC\C=C\C\C=C\C\C=C\C\C=C\CCCC(O)=O
|
|
MolPort-009-019-273 |
0.77 |
CCCCC\C=C/C\C=C/CCCC\C=C/CCCC(O)=O
|
|
MolPort-000-002-498 |
0.77 |
OC(=O)C1CCC=CC1
|
|
MolPort-003-937-818 |
0.77 |
CCCCC\C=C/C\C=C/C\C=C/CCCCC(O)=O
|
|
MolPort-022-366-452 |
0.77 |
CC1(CCC=CC1)C(O)=O
|
|
MolPort-009-019-253 |
0.77 |
CCCCC\C=C/CCCC\C=C/C\C=C/CCCC(O)=O
|
|
MolPort-035-706-341 |
0.77 |
C[C@H](CCC=C(C)C)[C@H]1CC[C@@]2(C)[C@@H]3CC[C@@H](C(=C)CO)[C@@]4(CCC(O)=O)C[C@@]34CC[C@]12C
|
|
MolPort-002-507-121 |
0.77 |
CC(=O)[C@H]1CC[C@H]2[C@@H]3CCC4=CC(=O)CC[C@]4(C)[C@H]3[C@H](O)C[C@]12C
|
|
MolPort-046-153-151 |
0.77 |
CC(CCC(O)C(C)(C)O)C1CCC2(C)C3=C(C(=O)CC12C)C1(C)CCC(=O)C(C)(C)C1CC3=O
|
|
MolPort-002-506-874 |
0.77 |
CC(=O)C1=CC[C@H]2[C@@H]3CC=C4C[C@@H](O)CC[C@]4(C)[C@H]3CC[C@]12C
|
|
MolPort-027-847-264 |
0.77 |
CC(C)CCCC(C)C1CCC2C3CC=C4CC(O)CC[C@]4(C=O)C3CC[C@]12C
|
|
MolPort-000-480-394 |
0.77 |
CC(=O)C1CCC2C3CCC4=CC(=O)CCC4(C)C3C(O)CC12C
|
|
MolPort-006-069-321 |
0.77 |
CC(=O)[C@H]1CC[C@H]2[C@@H]3CCC4=CC(=O)CC[C@]4(C)[C@H]3[C@@H](O)C[C@]12C
|
|
MolPort-003-892-389 |
0.77 |
CC(=O)C1=CCC2C3CC=C4CC(O)CCC4(C)C3CCC12C
|
|
MolPort-027-836-470 |
0.77 |
CC1(C)CC[C@@]2([C@H](O)C[C@]3(C)C(=CC[C@@H]4[C@@]5(C)C[C@H](O)[C@H](O)C(CO)(CO)[C@@H]5CC[C@@]34C)[C@@H]2C1)C(O)=O
|
|
MolPort-023-220-752 |
0.77 |
CC1(C)CC[C@@]2([C@H](O)C[C@]3(C)C(=CC[C@@H]4[C@@]5(C)C[C@H](O)[C@H](O)[C@@](C)(CO)C5CC[C@@]34C)[C@H]2C1)C(O)=O
|
|
MolPort-019-994-032 |
0.77 |
C[C@]12CC[C@H]3[C@@H](CCC4=C(O)C(=O)CC[C@]34C)[C@@H]1CC[C@@H]2O
|
|
MolPort-046-596-273 |
0.77 |
CC(=O)C1=C(C)CC2C3CC=C4CC(O)CC[C@]4(C)C3CC[C@]12C
|
|
MolPort-002-519-758 |
0.77 |
CC(C)CCC[C@@H](C)[C@H]1CCC2[C@@H]3CC=C4C[C@@H](O)CC[C@]4(C=O)C3CC[C@]12C
|
|
MolPort-003-958-619 |
0.77 |
C[C@H]1C[C@H]2[C@@H]3CC[C@H](C(C)=O)[C@@]3(C)C[C@H](O)[C@@H]2[C@@]2(C)CCC(=O)C=C12
|
|
MolPort-002-116-770 |
0.77 |
CC(=O)C1=C(C)CC2C3CC=C4CC(O)CCC4(C)C3CCC12C
|
|
MolPort-020-005-851 |
0.77 |
CC1(C)CC[C@@]2([C@H](O)C[C@]3(C)C(=CC[C@@H]4[C@@]5(C)C[C@H](O)[C@H](O)[C@@](C)(CO)[C@@H]5CC[C@@]34C)[C@@H]2C1)C(O)=O
|
|
MolPort-039-138-854 |
0.77 |
CCCCC(C)(C)[C@H](O)\C=C\[C@H]1CCC(=O)[C@@H]1C\C=C/CCCC(O)=O
|
|
MolPort-039-138-850 |
0.77 |
CCCCC[C@H](O)\C=C\[C@H]1CCC(=O)[C@@H]1C\C=C/CCCC(O)=O
|
|
MolPort-003-940-126 |
0.77 |
C[C@]12C[C@H](O)[C@H]3[C@@H](CCC4=CC(=O)CC[C@]34C)[C@@H]1CCC2=O
|
|
MolPort-001-742-437 |
0.77 |
CC(CCC1(C)C(C)CCC2(CO)C1CCC=C2CO)CC(O)=O
|
|
MolPort-002-526-521 |
0.77 |
C[C@]12C[C@@H](O)C3[C@@H](CCC4=CC(=O)CC[C@]34C)C1CCC2=O
|
|
MolPort-002-526-574 |
0.77 |
CC(=O)C1=CCC2[C@@H]3CC=C4C[C@H](O)CC[C@]4(C)C3CC[C@]12C
|
|
MolPort-046-765-329 |
0.77 |
C[C@]12CC[C@@H]3[C@@H](CCC4=C(O)C(=O)CC[C@H]34)[C@H]1CC[C@@H]2O
|
|
MolPort-046-765-405 |
0.77 |
C[C@]12C[C@H](O)[C@H]3[C@@H](CCC4=CC(=O)CC[C@]34C)[C@@H]1CC[C@H]2O
|
|
MolPort-003-892-478 |
0.77 |
C[C@]12CCC(=O)C=C1CC[C@H]1[C@@H]3CC[C@H](C(=O)CO)[C@@]3(CO)CC[C@H]21
|
|
MolPort-002-527-205 |
0.77 |
CC(=O)C1=C(C)CC2[C@@H]3CC=C4C[C@@H](O)CC[C@]4(C)C3CC[C@]12C
|
|
MolPort-002-510-335 |
0.77 |
CC(=O)[C@H]1CCC2[C@@H]3CCC4=CC(=O)CC[C@]4(C)C3[C@H](O)C[C@]12C
|
|
MolPort-027-835-540 |
0.77 |
CC1(C)CC[C@@]2([C@H](O)C[C@]3(C)C(=CC[C@@H]4[C@@]5(C)C[C@H](O)[C@H](O)[C@@](C)(CO)[C@@H]5CC[C@@]34C)[C@H]2C1)C(O)=O
|
|
MolPort-046-788-533 |
0.76 |
CC(C)=CCCC(C)(O)C1CC[C@]2(C)C1CC[C@@H]1[C@@]3(C)CCC(=O)C(C)(C)[C@@H]3CC[C@@]21C
|
|
MolPort-046-153-713 |
0.76 |
CC(C)=CCC[C@](C)(O)[C@H]1CC[C@]2(C)[C@@H]1CC[C@@H]1[C@@]3(C)CCC(=O)C(C)(C)[C@@H]3CC[C@@]21C
|
|
MolPort-002-528-276 |
0.76 |
CCCCC[C@H](O)\C=C\[C@H]1CCC(=O)[C@@H]1CCCCCCC(O)=O
|
|
MolPort-039-138-851 |
0.76 |
CCCCC[C@H](O)\C=C\[C@H]1CC[C@H](O)[C@@H]1CCCCCCC(O)=O
|
|
MolPort-002-683-774 |
0.76 |
CC(C)=C1C2CC2C2C(C12)C(O)=O
|
|
MolPort-039-138-852 |
0.76 |
CCCCC[C@H](O)\C=C\[C@H]1CC[C@@H](O)[C@@H]1CCCCCCC(O)=O
|
|
MolPort-039-052-452 |
0.76 |
C[C@H](CC\C=C(\C)C(O)=O)[C@H]1CC[C@@]2(C)[C@@H]3CC[C@@H](C(C)=C)[C@](C)(CCC(O)=O)C3=CC[C@]12C
|
|
MolPort-035-706-392 |
0.76 |
COC(=O)[C@@]12CCC3=C(CC[C@@H]4[C@@]5(C)CC[C@H](O)C(C)(C)[C@@H]5CC[C@@]34C)[C@@H]1CC(C)(C)CC2
|
|
MolPort-035-706-216 |
0.76 |
COC(=O)C(=C)[C@@H]1CC[C@@]2(C)CCCC(C)=C2C1
|
|
MCULE-8838919541 |
0.76 |
OC1(C(CC2CC=CC2)=O)CCCC1
|
|
MCULE-1248316974 |
0.76 |
C/C(/C)=C/CCC1(CCC(=O)CC1)O
|
|
MCULE-9852233406 |
0.76 |
OC(C(CC1CC=CC1)=O)=O
|
|
MCULE-7930269142 |
0.76 |
C12C(C1/C(/C1CC21)=C(\C)/C)C(O)=O
|
|
MCULE-1873537798 |
0.76 |
C([C@H]1CCC(=O)[C@@H]1CCCCCCC(O)=O)=C[C@H](CCCCC)O
|
|
MCULE-6809736977 |
0.76 |
COC(C1C2C=CC(CC2)C1)=O
|
|
MCULE-7100298727 |
0.76 |
COC([C@H]1[C@H]2C=C[C@H](CC2)C1)=O
|
|
MCULE-3490442378 |
0.76 |
C1C[C@]2(C)CC[C@@H](C(C(=O)OC)=C)CC2=C(C)C1
|
|
MCULE-9777116319 |
0.76 |
C1CC2(C(CCCC2)(CC=1)C(OC)=O)CCC(OC)=O
|
|
MCULE-6569170574 |
0.76 |
C1CC2(C(C3(C(C(C(C31)(C)C)O)C=O)C)CCC1C3C(C(C)=C)CCC3(CCC21C)C(=O)O)C
|
|
MCULE-8091131175 |
0.76 |
[C@@]12(C)CCC3(C([C@H](C(C)=C)CC3)C1CCC1C2(C)CCC2C1(C)CCC(=O)C2(C)C)C(=O)[O-].[K+]
|
|
MCULE-2845490138 |
0.76 |
[C@]123CC[C@H](C1)C(C(=C)[C@@]2([H])CC[C@@H]3C(O)=O)(C)C
|
|
MCULE-2112175098 |
0.76 |
CC(C1C2C3C(C)(CCC2(C(O)=O)CC1)C1(C)C(C2(C)C(CC1)C(CO)(C)C(O)CC2)CC3)=C
|
|
MCULE-6212623017 |
0.76 |
C1C[C@]2(C)[C@@]3([H])CC[C@]4([H])[C@@]5([H])[C@H](C(=C)C)CC[C@]5(C(=O)O)CC[C@]4([C@]3(C)CC[C@@]2([H])[C@@](CO)(C)[C@H]1O)C
|
|
MCULE-3459478440 |
0.76 |
CC(C(CC1CC=CC1)=O)(O)C
|
|
MCULE-5848120811 |
0.76 |
C1(=C)C2CCC1CC(C(O)=O)C2
|
|
MCULE-3558747073 |
0.76 |
[C@]12(CC[C@]3([C@@](CC[C@@]4([H])[C@](C)(CO)[C@H](CC[C@]34C)O)([C@]1(C)CC[C@@]1(C(O)=O)CC[C@@H](C(C)=C)[C@@]12[H])C)[H])[H]
|
|
MCULE-3719801152 |
0.76 |
[C@@H]1(O)C[C@@]2(C3CCC4C5[C@H](C(C)=C)CC[C@]5(C(=O)O)CC[C@]4([C@]3(C)CCC2C([C@H]1O)(C)C)C)C
|
|
MCULE-9909477927 |
0.76 |
OC(CC1CCCCC=1)=O
|
|
MCULE-4690400847 |
0.76 |
C1(CCCCCCC(=O)O)CC[C@@H](O)C=1
|
|
MCULE-6534469638 |
0.76 |
C(CCCCC=CCCCC)CCC(=O)OC
|
|
MCULE-6541953240 |
0.76 |
C1CCC(C(C)(C(O)=O)C)=CCCC1
|
|
MCULE-8140747078 |
0.76 |
C(CCCCCCCC=CCCCCCCCC)(OC)=O
|
|
MCULE-1052417281 |
0.76 |
C(CCCCCCCCCCCCCC=CCCCCCCCC)(OC)=O
|
|
MCULE-4995415924 |
0.76 |
C(CCC)CCCC/C=C\CCCCCCCC(=O)OC
|
|
MCULE-8493572612 |
0.76 |
C([H])(CCCCCCCC)=C(CCCCCCCCCCCC(=O)OC)[H]
|
|
MCULE-2350131012 |
0.76 |
C(CCCCCCCCC=CCCCCCC)(OC)=O
|
|
MCULE-5533097898 |
0.76 |
C(CCCC(=O)OC)CCCC=CCCCCCC
|
|
MCULE-7677256646 |
0.76 |
OC(C1(CC=CC1)CC1CCCC=1)=O
|
|
MCULE-3684696083 |
0.76 |
CCCCCC/C=C/CCCCCCCC(OC)=O
|
|
MCULE-8045534685 |
0.76 |
C(O)(C(CC)C1CCCCC=1)=O
|
|
MCULE-4750287883 |
0.76 |
C1=CCC(C(O)=O)(C)C(C(C)=O)([H])C1
|
|
MCULE-6949149768 |
0.76 |
C1C[C@]2(C)[C@@]3([H])CC=C4[C@]5([H])[C@@](O)(C)[C@H](C)CC[C@]5(C(=O)O)CC[C@@]4(C)[C@]3(C)C[C@@H](O)[C@@]2([H])[C@@](C=O)(C)[C@H]1O
|
|
MCULE-7720595428 |
0.76 |
C1[C@@]2(O)C=C[C@]3([C@]4([H])[C@@]5(C[C@]5([H])C(=O)[C@@]4(C)CC[C@]3([H])[C@@]2(C)CC[C@@H]1O)[H])[H]
|
|
MCULE-4849477341 |
0.76 |
[C@]12(C)CC(O)C3C(CCC4=CC(=O)CC[C@]34C)C1CC[C@]2(O)C(CO)=C
|
|
MCULE-5362337107 |
0.76 |
C12(C)C(C(C)CCC(O)=O)CCC1C1C(CC2O)C2(C)CCC(CC2=CC1O)O
|
|
MCULE-6950544067 |
0.76 |
[C@]12(C)CC[C@]3([C@@]([H])(CC=C4C[C@@H](O)CC[C@]34C)[C@]1([H])CC[C@@H]2[C@H](C)CCC(OC)=O)[H]
|
|
MCULE-3272252898 |
0.76 |
O=C1CCC2(CO)C3CCC4(C)C(CCC4(C3CCC2=C1)[H])C(O)=O
|
|
MCULE-3392411245 |
0.76 |
[C@]12(O)CCC(C=C1CC[C@]1([H])[C@]2([H])CC[C@]2([C@@]1([H])CCC2=O)C)=O
|
|
MCULE-9929818229 |
0.76 |
[Na+].[Na+].C1C2CC(C(C([O-])=O)C2C([O-])=O)C=1
|
|
MCULE-7240141445 |
0.76 |
[C@@]12([H])CC[C@H]([C@H](C)CCC(=O)OC)[C@@]1(C)CC[C@]1([H])[C@@]3(C)CC[C@H](O)CC3=CC[C@@]21[H]
|
|
MCULE-8805854090 |
0.76 |
[C@]12(C)CCC3C(CC=C4CC(O)CC[C@]34C)C1CCC2C(C)CCC(OC)=O
|
|
MCULE-3259874247 |
0.76 |
C1C[C@]2(C)[C@@]3([H])CC=C4[C@]5([H])[C@@](O)(C)[C@H](C)CC[C@]5(C(=O)O)CC[C@@]4(C)[C@]3(C)C[C@@H](O)[C@@]2([H])[C@@](CO)(C)[C@H]1O
|
|
MCULE-2479536906 |
0.76 |
[C@]12(C)CC[C@]3([C@@]([H])(CC=C4C[C@@H](O)CC[C@]34C)[C@]1([H])CC[C@@H]2C(OC)=O)[H]
|
|
MCULE-1391058013 |
0.76 |
C12(CC1)C1C=CC2C(C1C(O)=O)C(O)=O
|
|
MCULE-1397397840 |
0.76 |
O=C1CCC2(O)C3CCC4(C)CC(O)CC4C3CCC2=C1
|
|
MCULE-6501593178 |
0.76 |
C1(O)CC2(C(CO)C(C)=CC(=O)C2C(C)(C)C1)C
|
|
MCULE-3860629045 |
0.76 |
C12=CC(O)(C(C)C)CCC1C1(C(C(C(O)=O)(C)CCC1)CC2=O)C
|
|
MCULE-2247897001 |
0.76 |
COC(C1C2(C)C(C3C(CC2)C2(C)C(CC(CC2)O)=CC3)CC1)=O
|
|
MCULE-2036056204 |
0.76 |
C1CC2(C)C=C(C(=O)O)C(O)CC2C(C)(C)C1
|
|
MolPort-035-706-376 |
0.76 |
CC(=C)[C@@H]1CC[C@@]2(CC[C@]3(C)[C@H](CC[C@@H]4[C@@]5(C)C[C@@H](O)[C@H](O)C(C)(C)[C@@H]5CC[C@@]34C)[C@@H]12)C(O)=O
|
|
MolPort-039-338-114 |
0.76 |
CC(=C)[C@@H]1CC[C@@]2(CC[C@]3(C)[C@H](CC[C@@H]4[C@@]5(C)CC[C@H](O)[C@@](C)(CO)[C@@H]5CC[C@@]34C)[C@@H]12)C(O)=O
|
|
MolPort-005-945-582 |
0.76 |
CC(=C)[C@@H]1CC[C@@]2(CC[C@]3(C)[C@H](CCC4[C@@]5(C)CCC(=O)C(C)(C)C5C(O)C[C@@]34C)C12)C(O)=O
|
|
MolPort-002-525-668 |
0.76 |
[K+].CC(=C)[C@@H]1CC[C@@]2(CC[C@]3(C)[C@H](CC[C@@H]4[C@@]5(C)CCC(=O)C(C)(C)C5CC[C@@]34C)C12)C([O-])=O
|
|
MolPort-001-742-316 |
0.76 |
CC(=C)C1CCC2(CCC3(C)C(CCC4C5(C)C(C=O)C(O)C(C)(C)C5CCC34C)C12)C(O)=O
|
|
MolPort-001-741-356 |
0.76 |
CC(=C)[C@@H]1CC[C@@]2(CC[C@]3(C)C(CCC4[C@@]5(C)C[C@@H](O)[C@H](O)C(C)(C)C5CC[C@@]34C)C12)C(O)=O
|
|
MolPort-000-704-547 |
0.76 |
[K+].CC(=C)[C@@H]1CCC2(CC[C@]3(C)C(CCC4C5(C)CCC(=O)C(C)(C)C5CCC34C)C12)C([O-])=O
|
|
MolPort-001-742-556 |
0.76 |
CC1(C)[C@@H]2CC[C@]3(C2)[C@H](CC[C@@H]3C1=C)C(O)=O
|
|
MolPort-002-526-213 |
0.76 |
[Na+].CC(=C)[C@@H]1CC[C@@]2(CC[C@]3(C)[C@H](CC[C@@H]4[C@@]5(C)CCC(=O)C(C)(C)C5CC[C@@]34C)C12)C([O-])=O
|
|
MolPort-003-959-894 |
0.76 |
CCCCCC\C=C\CCCCCCCCCC(=O)OC
|
|
MolPort-003-938-950 |
0.76 |
CCCCCC\C=C\CCCCCCCC(=O)OC
|
|
MolPort-003-933-240 |
0.76 |
CCCCCCCC\C=C\CCCCCCCC(=O)OC
|
|
MolPort-001-740-140 |
0.76 |
CCCCCCCC\C=C/CCCCCCCC(=O)OC
|
|
MolPort-001-794-936 |
0.76 |
OC(=O)CC1=CCCCC1
|
|
MolPort-003-849-688 |
0.76 |
CCCCCCCCC=CCCCCCCCC(=O)OC
|
|
MolPort-003-941-737 |
0.76 |
CCCCCC\C=C/CCCCCCCCC(=O)OC
|
|
MolPort-044-650-173 |
0.76 |
CCCCCCCCCCCCCC\C=C\CCCC(=O)OC
|
|
MolPort-003-959-122 |
0.76 |
CCCCC\C=C/CCCCCCCCCCC(=O)OC
|
|
MolPort-003-959-376 |
0.76 |
CCCCCCCCCCC\C=C/CCCCC(=O)OC
|
|
MolPort-003-938-957 |
0.76 |
CCCCCC\C=C/CCCCCCCC(=O)OC
|
|
MolPort-001-741-355 |
0.76 |
OC(=O)CCCCCCC\C=C/CC(O)=O
|
|
MolPort-003-938-663 |
0.76 |
CCCC\C=C/CCCCCCCC(=O)OC
|
|
MolPort-003-916-055 |
0.76 |
CCCCCCCC\C=C/CCCCCCCCCCCC(=O)OC
|
|
MolPort-009-019-018 |
0.76 |
CCCCCCCC\C=C/CCCCCC(=O)OC
|
|
MolPort-003-927-107 |
0.76 |
CCCCCCCC\C=C/CCCCCCCCCC(=O)OC
|
|
MolPort-003-927-108 |
0.76 |
CCCCCC\C=C/CCCCCCCCCC(=O)OC
|
|
MolPort-008-155-609 |
0.76 |
C[C@]12CCC3C(CCC4=CC(=O)CC[C@]34O)C1CCC2=O
|
|
MolPort-046-765-476 |
0.76 |
[2H]C([2H])([2H])C([2H])(CCC[C@@H](C)[C@H]1CCC2C3[C@H](O)CC4=CC(=O)CC[C@]4(C)C3C[C@H](O)[C@]12C)C([2H])([2H])[2H]
|
|
MolPort-005-944-289 |
0.76 |
CC1=CC(=O)C2C(C)(C)CC(O)CC2(C)C1CO
|
|
MolPort-046-764-570 |
0.76 |
C[C@]12CC[C@@H]3[C@H]([C@H]1CCC2=O)C(=O)C=C1C[C@@H](O)CC[C@]31C
|
|
MolPort-046-765-410 |
0.76 |
C[C@]12CC[C@@H]3[C@@H](CCC4=CC(=O)CC[C@]34O)[C@H]1CCC2=O
|
|
MolPort-001-740-910 |
0.76 |
CC(C)C1(O)CCC2C(=C1)C(=O)CC1C2(C)CCCC1(C)C(O)=O
|
|
MolPort-002-506-876 |
0.76 |
COC(=O)CC[C@@H](C)[C@H]1CC[C@H]2[C@@H]3CC=C4C[C@@H](O)CC[C@]4(C)[C@H]3CC[C@]12C
|
|
MolPort-044-559-994 |
0.76 |
C[C@]12CCC3(O)[C@@H](CCC4=CC(=O)CC[C@]34C)[C@@H]1CCC2=O
|
|
MolPort-002-506-884 |
0.76 |
COC(=O)[C@H]1CC[C@H]2[C@@H]3CC=C4C[C@@H](O)CC[C@]4(C)[C@H]3CC[C@]12C
|
|
MolPort-002-511-796 |
0.76 |
COC(=O)C1CCC2C3CC=C4CC(O)CC[C@]4(C)C3CC[C@]12C
|
|
MolPort-006-668-579 |
0.76 |
CC1(C)CCCC2(C)C=C(C(O)CC12)C(O)=O
|
|
MolPort-023-330-852 |
0.76 |
C[C@]12CC[C@H]3[C@@H](C=C[C@]4(O)C[C@@H](O)CC[C@]34C)[C@@H]1[C@@H]1C[C@@H]1C2=O
|
|
MolPort-003-657-348 |
0.76 |
CC12CCC3C(C1CCC2=O)C(=O)C=C1CC(O)CCC31C
|
|
MolPort-039-338-084 |
0.76 |
[Na+].[Na+].[O-]C(=O)C1C2CC(C=C2)C1C([O-])=O
|
|
MolPort-046-196-704 |
0.76 |
CC(C)CCC[C@@H](C)[C@H]1CC[C@H]2[C@@H]3[C@H](O)CC4=CC(=O)CC[C@]4(C)[C@H]3C[C@H](O)[C@]12C
|
|
MolPort-005-934-304 |
0.76 |
C[C@]12CC[C@H]3[C@H]([C@@H]1CCC2=O)C(=O)C=C1C[C@@H](O)CC[C@]31C
|
|
MolPort-000-207-694 |
0.76 |
COC(=O)C1CCC2C3CC=C4CC(O)CCC4(C)C3CCC12C
|
|
MolPort-046-196-703 |
0.76 |
C[C@]12CC(O)[C@H]3[C@@H](CCC4=CC(=O)CC[C@]34C)[C@@H]1CC[C@@H]2C(O)C(O)=O
|
|
MolPort-035-706-454 |
0.76 |
C[C@@H]1CC[C@@]2(CC[C@]3(C)C(=CC[C@@H]4[C@@]5(C)CC[C@H](O)[C@@](C)(CO)[C@@H]5[C@H](O)C[C@@]34C)[C@@H]2[C@]1(C)O)C(O)=O
|
|
MolPort-000-823-748 |
0.76 |
COC(=O)CCC(C)C1CCC2C3CC=C4CC(O)CC[C@]4(C)C3CC[C@]12C
|
|
MolPort-035-706-447 |
0.76 |
C[C@@H]1CC[C@@]2(CC[C@]3(C)C(=CC[C@@H]4[C@@]5(C)CC[C@H](O)[C@@](C)(C=O)[C@@H]5[C@H](O)C[C@@]34C)[C@@H]2[C@]1(C)O)C(O)=O
|
|
MolPort-002-512-788 |
0.76 |
C[C@]12CC[C@H]3[C@@H](CCC4=CC(=O)CC[C@]34O)[C@@H]1CCC2=O
|
|
MolPort-002-521-223 |
0.76 |
COC(=O)CC[C@@H](C)[C@H]1CCC2[C@@H]3CC=C4C[C@H](O)CC[C@]4(C)C3CC[C@]12C
|
|
MolPort-002-994-694 |
0.76 |
OC(=O)C1C(C2C=CC1C21CC1)C(O)=O
|
|
MolPort-039-338-120 |
0.76 |
C[C@H](CC\C=C(/C)CO)[C@H]1CC[C@@]2(C)C3=C(CC[C@]12C)[C@@]1(C)CCC(O)C(C)(C)C1CC3=O
|
|
MolPort-002-511-069 |
0.76 |
C[C@]12CC(O)C3C(CCC4=CC(=O)CC[C@]34C)C1CC[C@]2(O)C(=C)CO
|
|
MolPort-035-706-401 |
0.76 |
COC(=O)[C@@]1(C)[C@@H](O)CC[C@@]2(C)[C@H]1CC[C@@]1(C)CC3=CC[C@H]4C(C)(C)[C@H](O)CC[C@]4(C)[C@H]3CC[C@H]21
|
|
MCULE-7173744939 |
0.75 |
C1C[C@]2(C)CC[C@@H](C(C(=O)O)=C)C=C2[C@@H](C)C1
|
|
MCULE-6577726631 |
0.75 |
CC1([C@@]2([H])[C@](C3CC[C@@]4(C)[C@@](C)(CC[C@@H]4[C@@H](CCCC(C)C)C)C=3CC2)(C)CC[C@@H]1O)C
|
|
MCULE-8869963478 |
0.75 |
C1(=O)CCC2(C)C3C(O)CC4(C)C(C(CO)=O)CCC4C3CCC2=C1
|
|
MCULE-3556089734 |
0.75 |
C1=CC2C1C(C(O)=O)C2C(O)=O
|
|
MCULE-5267198059 |
0.75 |
OC(C1(CC=CC1)CC1CCCCC1)=O
|
|
MCULE-1479199763 |
0.75 |
C1(=O)C(C)=CCC(C(C)CC(=O)O)(C(C(C)C)=O)C1
|
|
MCULE-2778793698 |
0.75 |
C12(C)CCC(C(C)CC/C=C(\C)/C)C1(C)CCC1C3C(C(C)(C)C(CC3)O)CCC2=1
|
|
MCULE-8500547238 |
0.75 |
CC1CC(C2(C(O)=O)CC=CC2)CCC1
|
|
MCULE-6672254923 |
0.75 |
C(=O)(O)C(C)(C)C1CC[C@@]2(C(CC=C3[C@]4([H])[C@@](O)(C)[C@H](C)CC[C@]4(C(=O)O)CC[C@@]23C)[C@@]1(C)CC(=O)O)C
|
|
MCULE-9513706661 |
0.75 |
C1CC2(C(CCC(C2CC/C(=C\CO)/C)=C)C(C1)(C(=O)O)C)C
|
|
MCULE-1352194754 |
0.75 |
C1CC2(C)C3CC=C4C5C(O)(C)C(C)CCC5(C(O)=O)CCC4(C)C3(C)CCC2C(C)(C)C1O
|
|
MCULE-9808647935 |
0.75 |
[H]C12C(C)(CCC(O)C1)C1(CCC3(C)C(C(C)C=CC(C)C(C)C)CCC3C1=CC2)[H]
|
|
MCULE-1627239407 |
0.75 |
C1C[C@]2(C)[C@@]3([H])CC[C@]4(C)[C@@]([H])([C@@H](CC[C@@H](CC)C(C)C)C)CC[C@@]4([H])[C@]3([H])C[C@@H](O)C2=CC1=O
|
|
MCULE-1085165933 |
0.75 |
[C@]12(C)CCC[C@](C)(C(=O)O)[C@]1([H])CCC(=C)[C@@H]2CCC(C)=CCO
|
|
MCULE-5371316798 |
0.75 |
C1C[C@]2(C)[C@@]3([H])CC[C@]4(C)[C@@]([H])([C@@H](/C=C/[C@H](C)C(C)C)C)CC[C@@]4([H])C3=CC[C@@]2([H])C[C@H]1O
|
|
MCULE-1280449807 |
0.75 |
CC1C(C(CC2C3C=CC(CC3)C2)=O)C1
|
|
MCULE-3406692868 |
0.75 |
CC1(C(CC2C3C=CC(CC3)C2)=O)CC1
|
|
MCULE-1010776591 |
0.75 |
C1C[C@@]2(C)C(C(C)(C)C1)C(=O)C=C(C)[C@@H]2CO
|
|
MCULE-7855057974 |
0.75 |
O=C(C1CCC1)CC1C2C=CC(CC2)C1
|
|
MCULE-5494176046 |
0.75 |
O[C@H]1CC[C@@]2(C)[C@@H](CC[C@@]3(C)CC4=CC[C@H]5C(C)(C)[C@@H](CC[C@]5(C)[C@H]4CC[C@H]23)O)C1(C)C
|
|
MCULE-8719465843 |
0.75 |
C12(C)CCC([H])(C(C)CC/C=C(\C)/C)C1(C)CCC1C3(C([H])(C(C)(C)C(CC3)O)CCC2=1)C
|
|
MCULE-5595700484 |
0.75 |
[H]C12CC=CCC1(C)C1CCC3(C)CCCC3C1C(C2)=O
|
|
MCULE-6927409255 |
0.75 |
C12CC[C@@]3([H])C(C)(C)[C@@H](O)CC[C@]3(C)C=1CC[C@]1(C)[C@H](CC[C@@]21C)[C@H](C)CC/C=C(/C)\C
|
|
MCULE-4589748840 |
0.75 |
NC(C(O)=O)CC1C2C=CC(CC2)C1
|
|
MCULE-6049121935 |
0.75 |
[H]C12C(C)(CCC(O)C1)C1(CCC3(C)C(C(C)CCC(C)C(C)C)CCC3C1=CC2)[H]
|
|
MCULE-8714614317 |
0.75 |
C=CC(CC1C2C=CC(CC2)C1)=O
|
|
MCULE-4050021987 |
0.75 |
[C@]12(C)CCC3[C@@]([H])(CCC4=CC(=O)CC[C@]34C)C1CC=C2C(CO)=O
|
|
MCULE-6520929159 |
0.75 |
C1C[C@]2(C)[C@@]3([H])[C@@H](O)C[C@]4(C)[C@@]([H])(C(CO)=O)CC[C@@]4([H])[C@]3([H])CCC2=CC1=O
|
|
MCULE-5212919737 |
0.75 |
CC(C(CC1C2C=CC(CC2)C1)=O)=C
|
|
MCULE-8499932204 |
0.75 |
C1C[C@]2(C)[C@@]3([H])CCC(=O)C=C3[C@H](O)C[C@@]2([H])[C@@](CO)(C)C1
|
|
MCULE-7281525757 |
0.75 |
C1(C)(C)C(CCC1=C)CC(O)=O
|
|
MCULE-4639928435 |
0.75 |
C1CC2(C)C3CCC4(C)C(C(C)=O)CCC4(C)C=3CCC2C(C)(C)C1=O
|
|
MCULE-5841728721 |
0.75 |
O=C1CC2(CC=C3C4CCC(C(C)CCC(C)C(C)C)C4(C)CCC3C2(C)C1)[H]
|
|
MCULE-6020208251 |
0.75 |
O[C@@H]1C(C)(C)[C@@]2([H])[C@](C3CC[C@]4(C)[C@@](CC[C@H]4[C@H](C)CC/C=C(/C)\C)(C)C=3CC2)(C)CC1
|
|
MCULE-6713995732 |
0.75 |
C1CC2(C)C3=CCC4(C)C(C(CCC(O)C(O)(C)C)C)CCC4(C)C3=CCC2C(C)(C)C1=O
|
|
MCULE-6821384626 |
0.75 |
O=C1CCC2(C)C3C(O)CC4(C)C(CCC4C3CCC2=C1)C(CO)(O)[H]
|
|
MCULE-6692951185 |
0.75 |
[C@@]12(C)CC[C@H]([C@H](C)CC/C=C(/C)\C)[C@@]1(C)CCC1[C@@]3([C@]([H])(C(C)(C)[C@H](CC3)O)CCC2=1)C
|
|
MCULE-1874567277 |
0.75 |
[C@@]12(C)[C@@H](C(CO)=O)CC[C@@]1([H])[C@]1([C@]([H])([C@@H](O)C2)[C@@]2(C)CCC(C=C2CC1)=O)[H]
|
|
MCULE-5866062254 |
0.75 |
O=C(C1CC1)CC1C2C=CC(CC2)C1
|
|
MCULE-4540266032 |
0.75 |
C(O)(=O)CC1CCCC1C=C
|
|
MCULE-2817082882 |
0.75 |
C1C[C@]2(C)[C@@]([H])(CC/C(/C)=C/CO)C(=C)CC[C@@]2([H])[C@@](C)(C(O)=O)C1
|
|
MCULE-4851646103 |
0.75 |
CC1CCC(C2(C(O)=O)CC=CC2)CC1
|
|
MCULE-5127489047 |
0.75 |
C12=CC[C@@]3([C@](C)(CC[C@H](O)[C@H]3C)C1CC[C@]1(C)[C@H](CCC12)[C@H](C)CCC(C(C)C)=CC)[H]
|
|
MolPort-039-338-623 |
0.75 |
C[C@@H]1CC[C@@]2(CC[C@]3(C)C(=CC[C@@H]4[C@@]5(C)CCC(=O)C(C)(C)[C@@H]5CC[C@@]34C)[C@@H]2[C@]1(C)O)C(O)=O
|
|
MolPort-044-723-310 |
0.75 |
CC[C@H](\C=C\[C@@H](C)[C@H]1CC[C@H]2[C@@H]3C[C@@H](O)C4=CC(=O)CC[C@]4(C)[C@H]3CC[C@]12C)C(C)C
|
|
MolPort-019-936-770 |
0.75 |
CC(=O)C1CCC2(C)C3=C(CCC12C)C1(C)CCC(=O)C(C)(C)C1CC3
|
|
MolPort-039-337-172 |
0.75 |
CC1(C)CC[C@@]2(CC[C@]3(C)C(=CC[C@@H]4[C@@]5(C)C[C@H](O)[C@H](O)[C@](C)([C@@H]5CC[C@@]34C)C(O)=O)[C@@H]2C1)C(O)=O
|
|
MolPort-039-052-462 |
0.75 |
C\C(CC[C@H]1C(=C)CC[C@@H]2[C@]1(C)CCC[C@]2(C)C(O)=O)=C/CO
|
|
MolPort-002-512-114 |
0.75 |
C[C@]12C[C@H](O)[C@H]3[C@@H](CCC4=CC(=O)CC[C@]34C)[C@@H]1CC[C@@H]2C(=O)CO
|
|
MolPort-035-706-218 |
0.75 |
C[C@H]1CCC[C@]2(C)CC[C@H](C=C12)C(=C)C(O)=O
|
|
MolPort-004-956-484 |
0.75 |
CC(C)CCC[C@@H](C)[C@H]1CC[C@H]2C3=CC[C@H]4C[C@@H](O)CC[C@]4(C)[C@H]3CC[C@]12C
|
|
MolPort-044-562-373 |
0.75 |
CC[C@H](CC[C@@H](C)[C@H]1CC[C@H]2C3=CC[C@H]4C[C@@H](O)CC[C@]4(C)[C@H]3CC[C@]12C)C(C)C
|
|
MolPort-039-194-134 |
0.75 |
CCC(\C=C\C(C)C1CC[C@H]2C3=CC[C@H]4CC(O)CC[C@]4(C)C3CC[C@]12C)C(C)C
|
|
MolPort-046-689-989 |
0.75 |
C[C@]12CC[C@H]3[C@@H](C[C@@H](O)C4=CC(=O)CC[C@]34C)[C@@H]1CCC2=O
|
|
MolPort-002-525-071 |
0.75 |
C\C=C(\CC[C@@H](C)[C@H]1CCC2C3=CC[C@H]4[C@H](C)[C@@H](O)CC[C@]4(C)C3CC[C@]12C)C(C)C
|
|
MolPort-046-761-814 |
0.75 |
C[C@]12C[C@H](O)[C@H]3[C@@H](CCC4=CC(=O)CC[C@]34C)[C@@H]1CC[C@@H]2C(=O)C=O
|
|
MolPort-005-943-420 |
0.75 |
CC(=O)[C@@]1(O)[C@H](O)C[C@H]2[C@@H]3CCC4=CC(=O)CC[C@]4(C)[C@H]3CC[C@]12C
|
|
MolPort-039-338-516 |
0.75 |
C[C@H](CCC=C(C)C)[C@H]1CC[C@@]2(C)[C@@H]3CCC4C(C)(C)[C@@H](O)CC[C@]4(C)C3=CC[C@]12C
|
|
MolPort-002-510-659 |
0.75 |
CC(=O)[C@H]1CCC2[C@@H]3CC[C@H]4CC(=O)CC[C@]4(C)C3=CC[C@]12C
|
|
MolPort-005-944-682 |
0.75 |
C[C@@H]1CC[C@@]2(CC[C@]3(C)C(=CCC4[C@@]5(C)CC[C@H](O)C(C)(C)C5CC[C@@]34C)C2[C@]1(C)O)C(O)=O
|
|
MolPort-044-723-276 |
0.75 |
C[C@@]1(CO)CCC[C@]2(C)[C@H]3CCC(=O)C=C3[C@H](O)C[C@@H]12
|
|
MolPort-039-338-446 |
0.75 |
CC1(C)CC[C@]2(C)CC[C@]3(C)C(=CC[C@@H]4[C@@]5(C)CC[C@H](O)C(C)(C)[C@@H]5[C@H](O)C[C@@]34C)[C@@H]2C1
|
|
MolPort-044-755-202 |
0.75 |
C[C@]12CC[C@H]3[C@@H](CC(=O)[C@@]4(O)CC=CC[C@]34C)[C@@H]1CCC2=O
|
|
MolPort-042-675-253 |
0.75 |
C[C@@H]1CC[C@@]2(CC[C@]3(C)C(=CCC4[C@@](C)(CC(O)=O)C(CC[C@@]34C)C(C)(C)C(O)=O)[C@@H]2[C@]1(C)O)C(O)=O
|
|
MolPort-028-599-898 |
0.75 |
CC1(C)[C@@H](O)CC[C@@]2(C)[C@H]1CC[C@@]1(C)CC3=CC[C@H]4C(C)(C)[C@@H](O)CC[C@]4(C)[C@H]3CC[C@H]21
|
|
MolPort-039-338-728 |
0.75 |
C[C@H](CCC=C(C)C)[C@H]1CC[C@@]2(C)C3=CCC4C(C)(C)[C@@H](O)CC[C@]4(C)C3CC[C@]12C
|
|
MolPort-001-739-597 |
0.75 |
CC1=CC(=O)C2C(C)(C)CCC[C@]2(C)[C@H]1CO
|
|
MolPort-002-509-760 |
0.75 |
C[C@]12CCC3[C@@H](CCC4=CC(=O)CC[C@]34C)C1CC=C2C(=O)CO
|
|
MolPort-006-169-225 |
0.75 |
CC(CCC=C(C)C)C1CCC2(C)C3=C(CCC12C)C1(C)CCC(O)C(C)(C)C1CC3
|
|
MolPort-046-687-421 |
0.75 |
CC(C)[C@@H]1CC[C@H]2[C@@]1(C)CC[C@@]1(C)[C@@H]3CC[C@H]4C(C)(C)[C@@H](O)CC[C@]4(C)C3=CC[C@]21C
|
|
MolPort-035-706-400 |
0.75 |
CC1(C)[C@@H](O)CC[C@@]2(C)[C@H]1CC[C@@]1(C)CC3=CC[C@H]4C(C)(C)[C@H](O)CC[C@]4(C)[C@H]3CC[C@H]21
|
|
MolPort-046-790-358 |
0.75 |
C[C@@H](CCC=C(C)C)[C@@H]1CC[C@]2(C)C3=C(CC[C@@]12C)[C@@]1(C)CC[C@H](O)C(C)(C)[C@@H]1CC3
|
|
MolPort-028-754-128 |
0.75 |
C[C@@H]1CC[C@@]2(CC[C@]3(C)C(=CC[C@@H]4[C@@]5(C)CC[C@H](O)C(C)(C)[C@@H]5CC[C@@]34C)[C@@H]2[C@]1(C)O)C(O)=O
|
|
MolPort-046-153-162 |
0.75 |
CC(CCC(O)C(C)(C)O)C1CCC2(C)C3=CCC4C(C)(C)C(=O)CCC4(C)C3=CCC12C
|
|
MolPort-027-945-607 |
0.75 |
CC(CCC=C(C)C)C1CCC2(C)C3=C(CCC12C)C1CCC(O)C(C)(C)C1CC3
|
|
MolPort-029-887-078 |
0.75 |
CC[C@H](\C=C\[C@@H](C)[C@H]1CC[C@H]2C3=CC[C@H]4C[C@@H](O)CC[C@]4(C)[C@H]3CC[C@]12C)C(C)C
|
|
MolPort-035-706-324 |
0.75 |
CC(C)[C@H]1CC[C@H]2[C@@]1(C)CC[C@@]1(C)[C@@H]3CC[C@H]4C(C)(C)[C@@H](O)CC[C@]4(C)C3=CC[C@]21C
|
|
MolPort-046-793-116 |
0.75 |
CC(C)CCC[C@@H](C)[C@H]1CC[C@H]2C3=CC[C@H]4[C@H](C)[C@H](O)CC[C@]4(C)[C@H]3CC[C@]12C
|
|
MolPort-000-146-138 |
0.75 |
C[C@H](CCC=C(C)C)[C@H]1CC[C@@]2(C)C3=C(CC[C@]12C)[C@@]1(C)CC[C@H](O)C(C)(C)[C@@H]1CC3
|
|
MolPort-035-706-300 |
0.75 |
CC[C@H](\C=C\[C@@H](C)[C@H]1CC[C@H]2C3=CC[C@H]4CC(=O)CC[C@]4(C)[C@H]3CC[C@]12C)C(C)C
|
|
MolPort-046-683-361 |
0.75 |
CC(C)CCC[C@@H](C)[C@H]1CC[C@H]2C3=CC[C@H]4C[C@H](O)CC[C@]4(C)[C@H]3CC[C@]12C
|
|
MolPort-035-706-287 |
0.75 |
CC(C)[C@@H](C)\C=C\[C@@H](C)[C@H]1CC[C@H]2C3=CC[C@H]4C[C@@H](O)CC[C@]4(C)[C@H]3CC[C@]12C
|
|
MolPort-035-706-191 |
0.75 |
CC1(C)CCC[C@]2(C)C=C(C=O)[C@H](O)C[C@@H]12
|
|
MolPort-044-183-055 |
0.75 |
[NaH].CCCCC\C=C/C\C=C/C\C=C/C\C=C/CCCC([O-])=O
|
|
MolPort-046-196-836 |
0.75 |
C[C@]12CC[C@H]3[C@@H](C[C@H](O)C4=CC(=O)CC[C@]34C)[C@@H]1CCC2=O
|
|
MolPort-028-599-899 |
0.75 |
CC(C)C(=C)CC[C@@H](C)[C@H]1CC[C@@]2(C)C3=C(CC[C@]12C)[C@@]1(C)CC[C@H](O)C(C)(C)[C@@H]1CC3
|
|
MolPort-039-338-146 |
0.75 |
C[C@H](CC[C@H](O)C(C)(C)O)[C@H]1CC[C@@]2(C)C3=CCC4C(C)(C)C(=O)CC[C@]4(C)C3=CC[C@]12C
|
|
MolPort-046-689-498 |
0.75 |
C[C@]12CC[C@H]3[C@@H](CC=C4[C@@H](O)[C@@H](O)CC[C@]34C)[C@@H]1CCC2=O
|
|
MolPort-027-836-465 |
0.75 |
C[C@H](CCC=C(C)C)[C@@H]1CC[C@]2(C)C3=C(CC[C@@]12C)[C@@]1(C)CC[C@H](O)C(C)(C)[C@@H]1CC3
|
|
MolPort-002-506-872 |
0.75 |
C[C@H](CCC=C(C)C)[C@H]1CC[C@@]2(C)C3=C(CC[C@]12C)[C@@]1(C)CC[C@H](O)C(C)(C)C1CC3
|
|
MolPort-003-892-472 |
0.75 |
CC12CC(O)C3C(CCC4=CC(=O)CCC34C)C1CCC2C(=O)CO
|
|
MolPort-046-689-150 |
0.75 |
[2H]C1=C2C([2H])([2H])C[C@H]3[C@@H]4CC[C@]([2H])(C(=O)C([2H])([2H])O)[C@@]4(C)C[C@H](O)[C@@H]3[C@@]2(C)CC([2H])([2H])C1=O
|
|
MolPort-039-338-835 |
0.75 |
C\C=C(\CC[C@@H](C)[C@H]1CC[C@H]2C3=CCC4C[C@@H](O)CC[C@]4(C)[C@H]3CC[C@]12C)C(C)C
|
|
MolPort-003-848-083 |
0.75 |
C[C@]12CC[C@H]3[C@@H](C[C@@H](O)C4=CC(=O)CC[C@]34C)[C@@H]1CC[C@@H]2O
|
|
MolPort-039-052-422 |
0.75 |
CC[C@H](CC[C@@H](C)[C@H]1CC[C@H]2[C@@H]3C[C@@H](O)C4=CC(=O)CC[C@]4(C)[C@H]3CC[C@]12C)C(C)C
|
|
MolPort-005-945-090 |
0.75 |
C\C(CCC1C(=C)CCC2C1(C)CCCC2(C)C(O)=O)=C\CO
|
|
MolPort-039-338-508 |
0.74 |
CC(C)C(=C)CC[C@H]([C@H]1[C@H](O)C[C@@]2(C)C3=CC[C@H]4C(C)(C)[C@@H](O)CC[C@]4(C)C3=CC[C@]12C)C(O)=O
|
|
MolPort-039-339-024 |
0.74 |
CC(C)=CCC[C@H]([C@H]1[C@H](O)C[C@@]2(C)C3=CC[C@H]4C(C)(C)[C@@H](O)CC[C@]4(C)C3=CC[C@]12C)C(O)=O
|
|
MolPort-039-338-560 |
0.74 |
CC(C)C(=C)CC[C@H]([C@H]1[C@H](O)C[C@@]2(C)C3=CC[C@H]4C(C)(C)[C@H](O)CC[C@]4(C)C3=CC[C@]12C)C(O)=O
|
|
MolPort-001-740-674 |
0.74 |
C[C@@]12CC[C@H](C[C@H]1[C@H](CCC1(O)[C@@H]3C[C@@H](CC[C@@]3(C)C=CC1=O)C(=C)C(O)=O)C(=O)C=C2)C(=C)C(O)=O
|
|
MolPort-039-338-563 |
0.74 |
CC(C)C(=C)CC[C@H]([C@H]1[C@H](O)C[C@@]2(C)C3=CC[C@H]4C(C)(C)C(=O)CC[C@]4(C)C3=CC[C@]12C)C(O)=O
|
|
MolPort-002-800-680 |
0.74 |
CC(C)(C)C1CCC(=CC1)C(O)=O
|
|
MolPort-023-332-906 |
0.74 |
CCCCCC1CC(O)=CC(=O)C1
|
|
MolPort-035-706-109 |
0.74 |
CC(C)[C@H]1CCC(C=O)=C[C@@H]1O
|
|
MolPort-027-640-932 |
0.74 |
CCCCC[C@H](O)\C=C\[C@H]1CC[C@H](O)[C@@H]1C\C=C/CCCC(O)=O
|
|
MolPort-001-742-733 |
0.74 |
CCCCCCCC(O)\C=C/C(O)CCC(O)CCCC(O)=O
|
|
MolPort-027-640-933 |
0.74 |
CCCCC[C@H](O)\C=C\[C@H]1CC[C@@H](O)[C@@H]1C\C=C/CCCC(O)=O
|
|
MolPort-002-526-712 |
0.74 |
CC1(C)[C@@H](O)CC[C@@]2(C)C1CC[C@]1(C)C2=CC=C2[C@@H]3C[C@](C)(CC[C@]3(C)CC[C@@]12C)C(O)=O
|
|
MolPort-039-052-627 |
0.74 |
CC(=O)\C=C\[C@@H]1C(=C)CC[C@H]2[C@@]1(C)CCC[C@]2(C)C(O)=O
|
|
MolPort-001-533-939 |
0.74 |
CC(C)=C1C2CCC1C(C2C(O)=O)C(O)=O
|
|
MolPort-003-958-817 |
0.74 |
CCCCC(C)(O)C\C=C\[C@H]1[C@H](O)CC(=O)[C@@H]1CCCCCCC(O)=O
|
|
MolPort-046-774-240 |
0.74 |
OC(=O)C12CCC(C1)C=C2
|
|
MolPort-039-061-801 |
0.74 |
C[C@H](C[C@H](O)[C@@H](O)C(C)(C)O)C1=C2C[C@H](O)[C@H]3[C@@]4(C)CCC(=O)C(C)(C)[C@@H]4CC[C@]3(C)[C@@]2(C)CC1
|
|
MolPort-046-703-359 |
0.74 |
CCCCC(C)(O)C\C=C\C1C(O)CC(=O)C1CCCCCCC(O)=O
|
|
MolPort-006-111-373 |
0.74 |
CC1=C(C(O)=O)C(C)(C)CCC1
|
|
MolPort-021-804-689 |
0.74 |
CC(C)CC(=O)CC(C)C1CCC(=CC1)C(O)=O
|
|
MolPort-006-395-227 |
0.74 |
[2H]C([2H])([2H])C(O)(C\C=C\[C@H]1[C@H](O)CC(=O)[C@@H]1CCCCCCC(O)=O)C([2H])([2H])CCC
|
|
MolPort-039-338-638 |
0.74 |
C[C@H](C[C@H](O)[C@@H](O)C(C)=C)C1=C2C[C@H](O)[C@H]3[C@@]4(C)CCC(=O)C(C)(C)[C@@H]4CC[C@]3(C)[C@@]2(C)CC1
|
|
MolPort-004-964-914 |
0.74 |
CCCCCC(=O)CC[C@H]1C=CC(=O)[C@@H]1C\C=C/CCCC(O)=O
|
|
MolPort-042-675-485 |
0.74 |
OC\C=C\CCCCCCCC(O)=O
|
|
MolPort-044-754-112 |
0.74 |
C[C@@H](O)CC[C@@H]1[C@H]2CC(=C(C)C)C(=O)C[C@@]12C
|
|
MolPort-035-706-315 |
0.74 |
C[C@H]1[C@@H]2[C@H]3CC[C@@H]4[C@@]5(C)CC[C@H](O)C(C)(C)[C@@H]5CC[C@@]4(C)[C@]3(C)CC[C@@]2(C)CC=C1C
|
|
MolPort-029-943-094 |
0.74 |
CC(CCC1C(=C)CCC2C1(C)CCCC2(C)C(O)=O)CC(O)=O
|
|
MolPort-028-754-127 |
0.74 |
CC1(C)CC[C@]2(C)CC=C3[C@]4(C)CC[C@H]5C(C)(C)[C@@H](O)CC[C@]5(C)[C@H]4CC[C@@]3(C)[C@@H]2C1
|
|
MolPort-035-705-910 |
0.74 |
C[C@@H](CCO)CC[C@H]1C(=C)CC[C@@H]2[C@]1(C)CCC[C@]2(C)C(O)=O
|
|
MolPort-003-892-645 |
0.74 |
C[C@@H]1CC[C@]2(C)CC[C@]3(C)C(=CC[C@@H]4[C@@]5(C)CC[C@H](O)C(C)(C)[C@@H]5CC[C@@]34C)[C@@H]2[C@H]1C
|
|
MolPort-039-338-300 |
0.74 |
CC1(C)CC[C@]2(C)CC=C3[C@]4(C)CC[C@H]5C(C)(C)[C@H](O)CC[C@]5(C)[C@H]4CC[C@@]3(C)[C@@H]2C1
|
|
MolPort-023-274-294 |
0.74 |
CC(CCO)CCC1C(=C)CCC2C(C)(C)CC(=O)CC12C
|
|
MolPort-039-052-487 |
0.74 |
CC1(C)CC[C@]2(C)CC=C3[C@]4(C)CC[C@H]5C(C)(C)C(=O)CC[C@]5(C)[C@H]4CC[C@@]3(C)[C@@H]2C1
|
|
MolPort-039-052-597 |
0.74 |
CC1(C)CC[C@]2(C)CC[C@]3(C)C(=CC[C@@H]4[C@@]5(C)CCC(=O)C(C)(C)[C@@H]5CC[C@@]34C)[C@@H]2C1
|
|
MolPort-022-365-475 |
0.74 |
C\C=C\CCCC(O)=O
|
|
MolPort-001-742-582 |
0.74 |
CC(CCO)CC[C@@H]1C(=C)CC[C@H]2[C@@]1(C)CCC[C@@]2(C)C(O)=O
|
|
MolPort-027-640-633 |
0.74 |
CC1(C)CC[C@]2(C)CC[C@]3(C)C(CC[C@@H]4[C@@]5(C)CCC(=O)C(C)(C)[C@@H]5CC[C@@]34C)=C2C1
|
|
MolPort-003-925-568 |
0.74 |
CC1(C)CC[C@]2(C)CC[C@]3(C)C(=CC[C@@H]4[C@@]5(C)CC[C@H](O)C(C)(C)[C@@H]5CC[C@@]34C)[C@@H]2C1
|
|
MolPort-039-338-134 |
0.74 |
CC1(C)CC[C@]2(C)CC[C@]3(C)C(CC[C@@H]4[C@@]5(C)CC[C@H](O)C(C)(C)[C@@H]5CC[C@@]34C)=C2C1
|
|
MCULE-1323295889 |
0.74 |
C1C[C@@H](C(C(O)=O)=C)C[C@@]2([H])C(O)(CC[C@@]3([H])[C@]4([H])C[C@H](C(=C)C(=O)O)CC[C@@]4(C)C=CC3=O)C(=O)C=C[C@@]21C
|
|
MCULE-9335291007 |
0.74 |
CC1(C(=O)CC[C@@]2(C)[C@H]1CC=C1[C@@]3(C)[C@]([C@H]([C@@H](C3)O)[C@H](C(=O)O)CCC(C(C)C)=C)(C)CC=C12)C
|
|
MCULE-1541926426 |
0.74 |
C1C[C@]2(C)C3=CC[C@@]4([C@@]([C@@H](C[C@@]4(C)C3=CC[C@@]2([H])C([C@H]1O)(C)C)O)([H])[C@H](C(O)=O)CCC(=C)C(C)C)C
|
|
MCULE-2797527002 |
0.74 |
C1(C(=O)O)=CCC(CCCCCC)CC1
|
|
MCULE-2959266522 |
0.74 |
CCCCCCCC(O)/C=C\C(CCC(O)CCCC(=O)O)O
|
|
MCULE-3750924928 |
0.74 |
C1C(C=O)=C[C@H](O)[C@@H](C(C)C)C1
|
|
MCULE-9150714373 |
0.74 |
C1(C(C)(C)CCCC=1C)C(O)=O
|
|
MCULE-8828485995 |
0.74 |
C[C@]12CC[C@@]3([H])C(C(=O)CC[C@]3(C)[C@]1([H])[C@H](CC1=C([C@H](C)C[C@H](O)[C@@H](O)C(=C)C)CC[C@]21C)O)(C)C
|
|
MCULE-5903352413 |
0.74 |
CCCCCC1CC(=CC(=O)C1)O
|
|
MCULE-7184031760 |
0.74 |
C[C@]12CC[C@@]3([H])C(C(=O)CC[C@]3(C)[C@]1([H])[C@H](CC1=C([C@H](C)C[C@H](O)[C@@H](O)C(O)(C)C)CC[C@]21C)O)(C)C
|
|
MCULE-5757363366 |
0.74 |
C12C3C4C=CCC4C1C(C)(C(OC)=O)C1C4CCC5(C)C(O)C3(C)C(C45)C21
|
|
MCULE-9857200349 |
0.74 |
C1(CCC(CC=1)C(C)(C)C)C(O)=O
|
|
MCULE-7258934827 |
0.74 |
C1C[C@@]2(C)[C@]([H])(/C=C/C(=O)C)C(=C)CC[C@]2([H])[C@](C(O)=O)(C)C1
|
|
MCULE-8342191825 |
0.74 |
C1(=C(C)C)C2CCC1C(C2C(O)=O)C(O)=O
|
|
MCULE-1183560917 |
0.74 |
C1(=O)C[C@@]2([C@]([H])(C/C/1=C(\C)/C)[C@@]2([H])CC[C@H](O)C)C
|
|
MCULE-4393909687 |
0.74 |
C1CC2(C)C(CCC(C)CC(=O)O)C(=C)CCC2C(C)(C(=O)O)C1
|
|
MCULE-4713145304 |
0.74 |
C1C[C@]2(C)[C@@]([H])(CC[C@@H](C)CCO)C(=C)CC[C@@]2([H])[C@@](C)(C(O)=O)C1
|
|
MCULE-6689462252 |
0.74 |
OCCCC1C2C=CC(CC2)C1
|
|
MCULE-2814899152 |
0.74 |
O=CC1(CCCCC1)CC1CC=CCC1
|
|
MCULE-3830868177 |
0.74 |
CC1CC(CC2CC=CCC2)C(=O)CC1
|
|
MCULE-3919531574 |
0.74 |
C1CC(CCC=1C)C(C)CO
|
|
MCULE-4490380859 |
0.74 |
O=C1CCC2(C)C3CC=C4C5(CC(C)(C)CCC5(C)CCC4(C)C3(C)CCC2(C1(C)C)[H])[H]
|
|
MCULE-4852376400 |
0.74 |
O=CCCC1C2C=CC(CC2)C1
|
|
MCULE-7859787767 |
0.74 |
CC(C(CC1CC=CCC1)=O)(C)C
|
|
MCULE-1097149426 |
0.74 |
OC1C(CC2CC=CCC2)CCCC1
|
|
MCULE-1741751705 |
0.74 |
C[C@]12[C@@]3(CC[C@H]4C(C)(C)C(=O)CC[C@]4(C)[C@H]3CC=C1[C@H]1[C@H](CCC(C1)(C)C)CC2)C
|
|
MCULE-2936092419 |
0.74 |
CC(C(C)=O)CC1C2C=CC(CC2)C1
|
|
MCULE-7089035597 |
0.74 |
C12=CCC3(C(C)(CCC4([H])C(C(O)CCC34C)(C)C)C1(C)CCC1(C)CCC(C)C(C)C21[H])[H]
|
|
MCULE-4888197133 |
0.74 |
C1(=O)CC2(C)C(CCC(C)CCO)C(=C)CCC2C(C)(C)C1
|
|
MCULE-3247130765 |
0.74 |
OC1CC(CC2CC=CCC2)CCC1
|
|
MCULE-5304256304 |
0.74 |
C(=O)(CCCC=C)CCCCCC(=O)O
|
|
MCULE-6531167311 |
0.74 |
CC(CCC1C2C=CC(CC2)C1)=O
|
|
MCULE-8330160340 |
0.74 |
[C@@]12(C)CCC[C@@](C)(C(O)=O)[C@@]1([H])CCC(=C)[C@H]2CCC(C)CCO
|
|
MCULE-5060620930 |
0.74 |
CC(C=O)(CC1C2C=CC(CC2)C1)C
|
|
MCULE-2960240255 |
0.74 |
O[C@H]1CC[C@@]2(C)[C@@H](CC[C@@]3(C)C4=CC[C@@]5(C)CCC(C)(C)C[C@H]5[C@]4(C)CC[C@H]23)C1(C)C
|
|
MCULE-6560423282 |
0.74 |
[C@H]1(CC(CC[C@@H]1C(O)=O)=CC/C=C(/C)\C)C(O)=O
|
|
MCULE-3124415982 |
0.74 |
C1(O)C(O)C2(C)C3CC=C4C5CC(C)(C)CCC5(C(=O)O)CCC4(C)C3(C)CCC2C(CO)(CO)C1=O
|
|
MCULE-2846082692 |
0.74 |
C(C(C1(C)C2C(C2C(=O)C=C1C(O)=O)(C)C)C)C(O)=O
|
|
MCULE-7552770733 |
0.74 |
C1CC2(C)C3C(=O)CC4(C)C(C(CCC(O)C(O)(C)C)C)CCC4(C)C=3C(O)CC2C(C)(C)C1=O
|
|
MCULE-4665716653 |
0.74 |
N(CC)(CC)CC.C12(C)CCC(O)CC1=CCC1C2CCC2(C)C(CCC21)(O)CCC(O)=O
|
|
MCULE-5380264709 |
0.74 |
C12(C)CCC3C(CCC4=CC(=O)CCC34C)C1CCC2C(OC)=O
|
|
MCULE-5828095144 |
0.74 |
[C@@]12([H])CC[C@H](C(=O)OC)[C@@]1(C)CC[C@]1([H])[C@@]3(C)CCC(=O)C=C3CC[C@@]21[H]
|
|
MCULE-1831569032 |
0.74 |
C1(CC(CCC1C(O)=O)=CC/C=C(\C)/C)C(O)=O
|
|
MCULE-3865951643 |
0.74 |
C1(C(O)=O)C(C)C(C)=CC(/C=C(/C)\C)C1C(O)=O
|
|
MCULE-6962013531 |
0.74 |
C1C[C@]2(C)[C@@]3([H])CC=C4[C@]5([H])[C@@](O)(C)[C@H](C)CC[C@]5(C(=O)O)CC[C@@]4(C)[C@]3(C)CC(=O)[C@@]2([H])[C@@](C=O)(C)[C@H]1O
|
|
MCULE-6711156232 |
0.74 |
[C@]12(C)CCC3C(CCC4=CC(=O)CC[C@]34C)C1CCC2C(C)CCC(OC)=O
|
|
MCULE-5587193921 |
0.74 |
C12(C)CCC3C(CCC4=CC(=O)CCC34C)C1CCC2C(C)CCC(OC)=O
|
|
MCULE-1243088880 |
0.74 |
C1=CC(C)C(C(=O)O)C(C(=O)O)C1
|
|
MCULE-5286515274 |
0.74 |
C1C(C(C)(C(=O)O)C(=O)O)C=CCC1
|
|
MCULE-3216123627 |
0.74 |
C1CC(C(C1(CC(=O)O)C)CC/C(=C/CCC(=O)C)/CO)C(C)(C)O
|
|
MCULE-6436563816 |
0.74 |
C(CCCCCC)CC1CC=1CCCCCCCC(=O)OC
|
|
MCULE-8439103614 |
0.74 |
OC1C(C2(C(O)=O)CC=CC2)CCCC1
|
|
MCULE-2964563648 |
0.74 |
C1(C(C)C=CC(C)C1C(O)=O)C(O)=O
|
|
MCULE-2217416730 |
0.74 |
C1C(C)C(C(O)=O)(C)C(C(O)=O)CC=1
|
|
MCULE-5258251736 |
0.74 |
C(O)(=O)C(CC=CCCCCCCCCCCCCC)CC(O)=O
|
|
MCULE-8429170945 |
0.74 |
C1C(CC(O)=O)C(C=C)CC=1
|
|
MCULE-8621711737 |
0.74 |
C12([H])CCC=CCCC1(C2C(OC)=O)[H]
|
|
MCULE-2960890696 |
0.74 |
C12C(C(=O)O)C3C4C(C(C(=O)O)C(C14)C=C2)C=C3
|
|
MCULE-5371407715 |
0.74 |
C12(CCC(C(=C)C1(C)C)C2)C(O)=O
|
|
MCULE-3449539268 |
0.74 |
C1CC2(C3CCC4C5C(C(C)=C)CCC5(CCC4(C(O)=O)C3(C)CCC2C(C)(C1O)C(=O)O)C(O)=O)C
|
|
MolPort-035-706-451 |
0.74 |
C[C@@H]1CC[C@@]2(CC[C@]3(C)C(=CC[C@@H]4[C@@]5(C)CC[C@H](O)[C@@](C)(C=O)[C@@H]5C(=O)C[C@@]34C)[C@@H]2[C@]1(C)O)C(O)=O
|
|
MolPort-002-514-753 |
0.74 |
COC(=O)CCC(C)C1CCC2C3CCC4=CC(=O)CC[C@]4(C)C3CC[C@]12C
|
|
MolPort-023-221-722 |
0.74 |
COC(=O)[C@H]1CC[C@H]2[C@@H]3CCC4=CC(=O)CC[C@]4(C)[C@H]3CC[C@]12C
|
|
MolPort-044-755-255 |
0.74 |
CC(=O)[C@]1(C)[C@H](O)CC2=C1CC[C@H]1[C@H]2CC=C2C[C@@H](O)CC[C@]12C
|
|
MolPort-002-161-277 |
0.74 |
CC(C)=CC\C=C1/CCC(C(C1)C(O)=O)C(O)=O
|
|
MolPort-046-153-150 |
0.74 |
CC(CCC(O)C(C)(C)O)C1CCC2(C)C3=C(C(=O)CC12C)C1(C)CCC(=O)C(C)(C)C1CC3O
|
|
MolPort-001-989-180 |
0.74 |
CC1C(C(C(C=C(C)C)C=C1C)C(O)=O)C(O)=O
|
|
MolPort-046-158-400 |
0.74 |
CC(=C)[C@@H]1CC[C@@]2(C)CC(=O)C=C(C)[C@@]2(O)C1
|
|
MolPort-002-508-860 |
0.74 |
CC(C)=CC\C=C1/CC[C@@H]([C@@H](C1)C(O)=O)C(O)=O
|
|
MolPort-000-207-693 |
0.74 |
COC(=O)C1CCC2C3CCC4=CC(=O)CCC4(C)C3CCC12C
|
|
MolPort-022-375-199 |
0.74 |
OC(=O)C(C1CCCC=C1)C(O)=O
|
|
MolPort-029-996-101 |
0.74 |
COC(=O)[C@H]1[C@H]2CC\C=C/CC[C@@H]12
|
|
MolPort-002-135-154 |
0.74 |
CC1C=CC(C)C(C1C(O)=O)C(O)=O
|
|
MolPort-029-996-102 |
0.74 |
COC(=O)[C@@H]1[C@H]2CC\C=C/CC[C@@H]12
|
|
MolPort-003-664-396 |
0.74 |
CC1=C(O)C(=O)CC(C)(C)C1
|
|
MolPort-006-390-553 |
0.74 |
CC1C=CCC(C1C(O)=O)C(O)=O
|
|
MolPort-038-386-610 |
0.74 |
C\C(CO)=C/CCC(CO)C1CCC2(C)C3CCC(C(=C)CO)C4(CCC(O)=O)CC34CCC12C
|
|
MolPort-046-201-849 |
0.74 |
COC(=O)C1CCC=CCC1
|
|
MolPort-002-857-394 |
0.74 |
CCCCCCCCCCCCC\C=C\CC(CC(O)=O)C(O)=O
|
|
MolPort-002-501-817 |
0.74 |
CC1C=CC[C@H]([C@H]1C(O)=O)C(O)=O
|
|
MolPort-035-706-375 |
0.74 |
CC(=C)[C@@H]1CC[C@@]2(CC[C@]3(C)[C@H](CC[C@@H]4[C@@]5(C)[C@H]([C@H](O)C(C)(C)[C@@H]5CC[C@@]34C)C(O)=O)[C@@H]12)C(O)=O
|
|
MolPort-000-252-835 |
0.74 |
CC1(C)C(=C)C2CCC1(C2)C(O)=O
|
|
MolPort-005-945-548 |
0.74 |
CC(=C)C1CCC2(CCC3(C(CCC4C5(C)CCC(O)C(C)(C5CCC34C)C(O)=O)C12)C(O)=O)C(O)=O
|
|
MolPort-001-741-019 |
0.74 |
CC(=C)[C@@H]1CC[C@@]2(CC[C@]3(C)C(CCC4[C@@]5(C)[C@H]([C@H](O)C(C)(C)C5CC[C@@]34C)C(O)=O)C12)C(O)=O
|
|
MolPort-035-706-448 |
0.73 |
C[C@@H]1CC[C@@]2(CC[C@]3(C(O)=O)C(=CC[C@@H]4[C@@]5(C)CC[C@H](O)C(C)(C)[C@@H]5CC[C@@]34C)[C@@H]2[C@H]1C)C(O)=O
|
|
MolPort-002-911-143 |
0.73 |
C[C@]1(O)CCC2C3CCC4=CC(=O)C(=C)CC4(C)C3CCC12C
|
|
MolPort-002-510-183 |
0.73 |
C[C@]12CCC3[C@@H](CCC4=CC(=O)CC[C@]34CO)C1CCC2=O
|
|
MolPort-038-386-599 |
0.73 |
C[C@@H]1CC[C@@]2(CC[C@]3(C)C(=CCC4[C@@]5(C)C[C@@H](O)[C@H](O)C(C)(C)C5CC[C@@]34C)[C@@H]2[C@]1(C)O)C(O)=O
|
|
MolPort-028-610-172 |
0.73 |
CC1(CCC2C(=C1)C(=O)CC1C2(C)CCCC1(C)C(O)=O)C=C
|
|
MolPort-004-786-165 |
0.73 |
C[C@]12CC[C@H]3[C@H]([C@@H]1CCC2=O)[C@H](O)C=C1C[C@@H](O)CC[C@]31C
|
|
MolPort-035-706-438 |
0.73 |
C[C@@H]1CC[C@@]2(CC[C@]3(C)C(=CC[C@@H]4[C@@]5(C)C[C@@H](O)[C@@H](O)C(C)(C)[C@@H]5CC[C@@]34C)[C@@H]2[C@]1(C)O)C(O)=O
|
|
MolPort-039-052-559 |
0.73 |
COC(C)(C)[C@@H](O)[C@H](O)C[C@H](C)[C@@H]1CC[C@]2(C)C3=CC[C@H]4C(C)(C)C(=O)CC[C@]4(C)[C@H]3CC[C@@]12C
|
|
MolPort-004-786-162 |
0.73 |
C[C@]12CC[C@H]3[C@H]([C@@H]1CCC2=O)[C@@H](O)C=C1C[C@@H](O)CC[C@]31C
|
|
MolPort-005-944-940 |
0.73 |
CC1(C)CC[C@@]2(CC[C@]3(C)C(=CCC4[C@@]5(C)C[C@@H](O)[C@H](O)C(C)(C)C5CC[C@@]34C)[C@@H]2[C@@H]1O)C(O)=O
|
|
MolPort-046-765-264 |
0.73 |
C[C@]12CC[C@H]3[C@@H](CC=C4C[C@@H](O)CC[C@]34C)[C@H]1C=CC2=O
|
|
MolPort-039-052-516 |
0.73 |
C[C@H](CC[C@H](O)[C@](C)(O)CO)[C@H]1CC[C@@]2(C)C3=CCC4C(C)(C)C(=O)CC[C@]4(C)C3=CC[C@]12C
|
|
MolPort-002-526-056 |
0.73 |
CC(=O)[C@H]1CCC2[C@@H]3CCC4=CC(=O)CC[C@]4(CO)C3CC[C@]12C
|
|
MolPort-006-170-502 |
0.73 |
N[C@@H]1CC\C=C/CC[C@@H]1C(O)=O
|
|
MolPort-027-720-808 |
0.73 |
CCC(=O)[C@@]1(O)CC[C@H]2[C@@H]3CCC4=CC(=O)CC[C@]4(C)[C@H]3[C@@H](O)C[C@]12C
|
|
MolPort-001-740-583 |
0.73 |
C[C@@H]1CC[C@@]2(CC[C@]3(C)C(=CCC4[C@@]5(C)C[C@@H](O)[C@@H](O)C(C)(C)C5CC[C@@]34C)C2[C@]1(C)O)C(O)=O
|
|
MolPort-035-706-464 |
0.73 |
C[C@@H]1CC[C@@]2(CC[C@]3(C)C(=CC[C@@H]4[C@@]5(C)C[C@H](O)[C@H](O)C(C)(C)[C@@H]5CC[C@@]34C)[C@@H]2[C@]1(C)O)C(O)=O
|
|
MolPort-039-338-477 |
0.73 |
CC1(C)[C@@H](O)C(=O)C=C2[C@H]1CC[C@@H]1C[C@@](C)(CC[C@@]21C)C=C
|
|
MolPort-035-706-466 |
0.73 |
C[C@@H]1CC[C@@]2(CC[C@]3(C)C(=CC[C@@H]4[C@@]5(C)CC(=O)[C@H](O)C(C)(C)[C@@H]5CC[C@@]34C)[C@@H]2[C@]1(C)O)C(O)=O
|
|
MolPort-005-945-884 |
0.73 |
CC1CCC2(CCC3(C)C(=CCC4C5(C)CCC(O)C(C)(CO)C5CCC34C)C2C1(C)O)C(O)=O
|
|
MolPort-046-689-959 |
0.73 |
C[C@]12CC[C@H]3[C@@H](CC=C4C[C@@H](O)CC[C@]34C)[C@@H]1C=CC2=O
|
|
MolPort-028-599-904 |
0.73 |
C[C@@H]1CC[C@@]2(CC[C@]3(C)C(=CC[C@@H]4[C@@]5(C)C[C@@H](O)[C@H](O)C(C)(C)[C@@H]5CC[C@@]34C)[C@@H]2[C@]1(C)O)C(O)=O
|
|
MolPort-046-790-392 |
0.73 |
C[C@@H]1CC(=O)C=C2[C@H](O)C[C@@H]3[C@@H](C3(C)C)[C@@]12C
|
|
MolPort-035-706-111 |
0.73 |
CC(C)(O)[C@H]1CCC(=CC1)C(O)=O
|
|
MolPort-028-754-175 |
0.73 |
C[C@@H]1CC[C@@]2(CC[C@]3(C)C(=CC[C@@H]4[C@@]5(C)CC[C@H](O)[C@@](C)(CO)[C@@H]5CC[C@@]34C)[C@@H]2[C@]1(C)O)C(O)=O
|
|
MolPort-030-084-563 |
0.73 |
C[C@]12CC[C@H]3[C@@H](CCC4=CC(=O)CC[C@]34CO)[C@@H]1CCC2=O
|
|
MolPort-039-338-384 |
0.73 |
C[C@@H]1CC[C@@]2(CC[C@]3(C)C(=CC[C@@H]4[C@@]5(C)CC[C@@H](O)[C@](C)(CO)[C@@H]5CC[C@@]34C)[C@@H]2[C@]1(C)O)C(O)=O
|
|
MolPort-046-683-050 |
0.73 |
N[C@H]1CC\C=C/CC[C@H]1C(O)=O.N[C@@H]1CC\C=C/CC[C@@H]1C(O)=O
|
|
MolPort-020-005-967 |
0.73 |
CC1(C)CC[C@@]2(CC[C@]3(C)C(=CC[C@@H]4[C@@]5(C)C[C@@H](O)[C@H](O)C(C)(C)[C@@H]5CC[C@@]34C)[C@@H]2[C@@H]1O)C(O)=O
|
|
MolPort-002-510-704 |
0.73 |
C[C@]12CCC3[C@@H](CCC4=CC(=O)CC[C@]34CO)C1CC[C@@H]2O
|
|
MolPort-044-723-229 |
0.73 |
C[C@H](CC[C@H](O)[C@](C)(O)CO)[C@H]1CC[C@@]2(C)C3=CC[C@H]4C(C)(C)C(=O)CC[C@]4(C)C3=CC[C@]12C
|
|
MolPort-006-113-734 |
0.73 |
CC(=O)[C@@]1(O)CC[C@H]2[C@@H]3CCC4=CC(=O)CC[C@]4(C)[C@H]3C(=O)C[C@]12C
|
|
MolPort-042-675-252 |
0.73 |
CC1CCC2(CCC3(C)C(=CCC4C5(C)CC(O)C(=O)C(C)(C)C5CCC34C)C2C1(C)O)C(O)=O
|
|
MolPort-046-153-161 |
0.73 |
CC(CCC(O)C(C)(O)CO)C1CCC2(C)C3=CCC4C(C)(C)C(=O)CCC4(C)C3=CCC12C
|
|
MolPort-046-761-042 |
0.73 |
C[C@@H]1CC[C@@]2(CC[C@]3(C)C(=CC[C@@H]4[C@@]5(C)C[C@@H](O)C(=O)C(C)(C)[C@@H]5CC[C@@]34C)[C@@H]2[C@]1(C)O)C(O)=O
|
|
MolPort-009-018-338 |
0.73 |
CCCC1(CCC1)[C@H](O)C\C=C\[C@H]1C(O)CC(=O)C1C\C=C/CCCC(O)=O
|
|
MolPort-019-936-761 |
0.73 |
CC1(CCC2C(=C1)C(O)CC1C2(C)CCCC1(C)C(O)=O)C=C
|
|
MolPort-046-792-935 |
0.73 |
CC(=O)[C@]1(O)CC[C@@H]2[C@@H]3CCC4=CC(=O)CC[C@]4(C)[C@@H]3C(=O)C[C@]12C
|
|
MolPort-035-706-267 |
0.73 |
C[C@H](O)CC[C@@]1(O)C(C)=CC(=O)CC1(C)C
|
|
MolPort-046-596-344 |
0.73 |
C[C@]12CCC3C(CCC4=CC(=O)CC[C@]34CO)C1CCC2O
|
|
MolPort-035-706-266 |
0.73 |
C[C@@H](O)CC[C@@]1(O)C(C)=CC(=O)CC1(C)C
|
|
MolPort-006-112-202 |
0.73 |
CC(=O)[C@@]1(O)CC[C@H]2[C@@H]3CCC4=CC(=O)CC[C@]4(C)[C@H]3[C@@H](O)C[C@]12C
|
|
MolPort-009-019-192 |
0.73 |
CCCCC\C=C/C\C=C/CC\C=C/CCCC(O)=O
|
|
MolPort-003-895-953 |
0.73 |
CC1(CCCC=C1)C(O)=O
|
|
MolPort-029-887-059 |
0.73 |
C\C(C=C)=C/C[C@H]1C(=C)CC[C@@H]2[C@]1(C)CCC[C@]2(C)C(O)=O
|
|
MolPort-039-338-334 |
0.73 |
C\C(C=C)=C/C[C@H]1C(=C)CC[C@@H]2[C@]1(C)CCC[C@@]2(C)C(O)=O
|
|
MolPort-022-365-292 |
0.73 |
OC(=O)C1CCCC=C1
|
|
MolPort-042-624-137 |
0.73 |
C\C=C1/[C@@H]2C[C@H](O)CC[C@]2(C)[C@H]2CC[C@]3(C)[C@H](CC[C@H]3[C@@H]2C1=O)[C@H](C)CCC(O)=O
|
|
MolPort-005-945-680 |
0.73 |
CC12CCCC(C)(C1CCC(=C)C2CC\C(CO)=C/CO)C(O)=O
|
|
MolPort-039-338-149 |
0.73 |
C\C(C=O)=C/C[C@H]1C(=C)CC[C@@H]2[C@]1(C)CCC[C@@]2(C)C(O)=O
|
|
MCULE-8671876949 |
0.73 |
C12CC(C3C(=O)C(O)C13)C=C2
|
|
MCULE-3986896794 |
0.73 |
CC1([C@@H](O)[C@H](O)C[C@@]2(C)[C@H]1CC[C@]1([C@@]3(C)C([C@@H]4[C@@](O)(C)[C@H](C)CC[C@]4(C(=O)O)CC3)=CC[C@@H]12)C)C
|
|
MCULE-9024219601 |
0.73 |
C1C2(CO)C(CCC3C2CCC2(C)C3CCC2=O)=CC(=O)C1
|
|
MCULE-7932579394 |
0.73 |
O=C1CCC2(C)C3CCC4(C)C(CCC4C3CC(O)C2=C1)C(CO)=O
|
|
MCULE-3353799719 |
0.73 |
[C@]12(C)CCC3[C@@]([H])(CCC4=CC(=O)CC[C@]34CO)C1CC[C@@H]2C(C)=O
|
|
MCULE-9742304708 |
0.73 |
C1C(C(O)=O)=CC[C@@H](C(O)(C)C)C1
|
|
MCULE-8998480466 |
0.73 |
C1(CC=CCC1)C(N)C(=O)O
|
|
MCULE-9482226349 |
0.73 |
C12=CC[C@]3([C@@](C)(CC[C@@]4([H])C([C@@H](O)[C@H](O)C[C@]34C)(C)C)[C@]1(C)CC[C@]1(CC[C@@H](C)[C@@](C)(O)[C@@]21[H])C(O)=O)[H]
|
|
MCULE-3751237146 |
0.73 |
C[C@H]1[C@](O)(C)[C@@H]2[C@@](C(=O)O)(CC[C@]3([C@@]4(C)[C@@H]([C@@]5([C@@H](CC4)[C@@](CO)(C)[C@@H](O)CC5)C)CC=C32)C)CC1
|
|
MCULE-3559356203 |
0.73 |
O=C1CCC2(CO)C3CCC4(C)C(CCC4C3CCC2=C1)C(C)=O
|
|
MCULE-8008111833 |
0.73 |
[C@]12(CO)CCC(C=C1CC[C@]1([H])C2CC[C@]2(C1CCC2=O)C)=O
|
|
MCULE-2170216646 |
0.73 |
O=C1CCC2(C)C3CCC4(C)C(O)(CCC4C3CC(O)C2=C1)C(C)=O
|
|
MCULE-7009109930 |
0.73 |
C1CC2(C)C3=CCC4(C)C(C(CCC(O)C(O)(C)CO)C)CCC4(C)C3=CCC2C(C)(C)C1=O
|
|
MCULE-4704690733 |
0.73 |
C1C[C@]2(C)[C@@]3([H])CC=C4[C@]5([H])[C@@](O)(C)[C@H](C)CC[C@]5(C(=O)O)CC[C@@]4(C)[C@]3(C)CC[C@@]2([H])[C@@](CO)(C)[C@H]1O
|
|
MCULE-5797410500 |
0.73 |
O=C1CCC2(C)C3C(O)CC4(C)C(O)(CCC4C3CCC2=C1)C(C)=O
|
|
MCULE-8942317491 |
0.73 |
[C@@H]1(O)C[C@@]2([C@@]3([H])CC=C4[C@@]5([H])[C@](CC[C@@]4(C)[C@]3(C)CC[C@@]2([H])C([C@H]1O)(C)C)(C(=O)O)CCC(C)(C)[C@H]5O)C
|
|
MCULE-9301209033 |
0.73 |
[C@]12(CO)CCC(=O)C=C1CC[C@@]1([H])[C@]3([H])CCC(=O)[C@@]3(C)CC[C@]21[H]
|
|
MCULE-5689703166 |
0.73 |
C1C[C@]2(C)[C@@]3([H])CC=C4[C@]5([H])[C@@](O)(C)[C@H](C)CC[C@]5(C(O)=O)CC[C@@]4(C)[C@]3(C)CC[C@@]2([H])[C@@](C)(CO)[C@@H]1O
|
|
MCULE-7638135284 |
0.73 |
C1(O)CC2(C)C3CC=C4C5C(O)(C)C(C)CCC5(C(=O)O)CCC4(C)C3(C)CCC2C(C)(C)C1=O
|
|
MCULE-3516804753 |
0.73 |
C1C[C@]2(C)[C@@]3([H])[C@@H](O)C[C@]4(C)[C@@H](C(C(O)O)=O)CC[C@@]4([H])[C@]3([H])CCC2=CC1=O
|
|
MCULE-2810354958 |
0.73 |
C12CCC3=CC(C(=C)CC3(C)C1CCC1(C)[C@](CCC21)(O)C)=O
|
|
MCULE-8312923448 |
0.73 |
C12CCCC(=O)C=1CC(C(=O)O)CC2
|
|
MCULE-9310117393 |
0.73 |
C1CC2(C)C3CCC(C)(C=C)C=C3C(O)CC2C(C(=O)O)(C)C1
|
|
MCULE-1404184811 |
0.73 |
C1CC2(C3CC=C4C5C(O)(C)C(C)CCC5(C(O)=O)CCC4(C)C3(C)CCC2C(CO)(C)C1O)C
|
|
MCULE-4963816026 |
0.73 |
O=C1CCC2(C)C3CCC4(C)CCC(O)C4C3CC(O)C2=C1
|
|
MCULE-7712069033 |
0.73 |
C12CCC3=CC(C(=C)CC3(C)C1CCC1(C)C(CCC21)O)=O
|
|
MCULE-6649773698 |
0.73 |
C1CC2(C(CCC(C2CC/C(=C\CO)/CO)=C)C(C(O)=O)(C)C1)C
|
|
MCULE-7610148262 |
0.73 |
C1C(C(=O)O)(C)C=CCC1
|
|
MCULE-3305395898 |
0.73 |
C12C3C4C5C1C(C1C5C5C4C(C(O)C5C1=O)C3=O)C=C2
|
|
MCULE-6354515204 |
0.73 |
C1C[C@]2(C)[C@@]([H])(C/C=C(\C)/C=O)C(=C)CC[C@@]2([H])[C@@](C(O)=O)(C)C1
|
|
MCULE-3556948980 |
0.73 |
C1C[C@]2(C)[C@@]([H])(C/C=C(\C)/C=C)C(=C)CC[C@@]2([H])[C@](C(O)=O)(C)C1
|
|
MCULE-5844706578 |
0.73 |
C1C[C@]2(C)[C@@]([H])(C/C=C(\C)/C=C)C(=C)CC[C@@]2([H])[C@@](C(O)=O)(C)C1
|
|
MCULE-6370581589 |
0.73 |
CC=CC(CC1C2C=CC(CC2)C1)=O
|
|
MCULE-5575338469 |
0.73 |
C/C(/C)=C/C(CC1C2C=CC(CC2)C1)=O
|
|
MCULE-3240845890 |
0.73 |
C1C[C@@]2(C)[C@@](C[C@H](C(C(=O)O)=C)CC2)([C@@](C1)(O)C)[H]
|
|
MCULE-9000633244 |
0.73 |
OC(C=O)CC1CC=CC1
|
|
MCULE-1897348776 |
0.73 |
O=C1C2CC=CCC2CC2CC=CCC21
|
|
MCULE-5865455343 |
0.73 |
CC(C=O)(CC1CC=CC1)O
|
|
MCULE-8675761077 |
0.73 |
[C@]12([H])[C@@](C)(CCC[C@]1(C)CC[C@H](C2)C(=C)C(O)=O)O
|
|
MCULE-7081301004 |
0.73 |
OC[C@H]1[C@H]2C=C[C@H](CC2)C1
|
|
MCULE-9093112563 |
0.73 |
CC([C@H]1[C@H]2C=C[C@H](CC2)C1)=O
|
|
MCULE-6153090139 |
0.73 |
C1C2CCC(CC2C=O)C=1
|
|
MCULE-9204788308 |
0.73 |
C12C(C)(CCCC1(C)CCC(C2)C(=C)C(O)=O)O
|
|
MCULE-4945902509 |
0.73 |
O=C(C1CC2C(C2)C1)CC1CC=CCC1
|
|
MCULE-2232302900 |
0.73 |
C1(CC2CCC1C=C2)C(C)=O
|
|
MCULE-7628079142 |
0.73 |
O=C(C1C2C1CCC2)CC1CC=CCC1
|
|
MCULE-2632444883 |
0.73 |
C12[C@](C)(CCC[C@]1(C)CC[C@H](C2)C(=C)C(O)=O)O
|
|
MCULE-5000750749 |
0.73 |
C1C2C3C(C4CC3C(O)C4)C(C2)C=1
|
|
MCULE-2354192149 |
0.73 |
O=C(C12CCCC1C2)CC1CC=CCC1
|
|
MCULE-5485844450 |
0.73 |
C1CC2(C)C3CCC4(C)C(C(CC/C=C(\C)/C)C(O)=O)CCC4(C)C=3CCC2C(C)(C)C1OC(=O)C
|
|
MCULE-9253743476 |
0.73 |
CC1([C@H](OC(=O)C)CC[C@@]2(C)[C@H]1CCC1[C@@]3(C)[C@]([C@@H]([C@H](C(=O)O)CC/C=C(/C)\C)CC3)(C)CCC=12)C
|
|
MCULE-5424518807 |
0.73 |
C1=CCC2(C(C1)(CC#N)CCCC2)C(O)=O
|
|
MCULE-5544927487 |
0.73 |
[C@H]1(O)C[C@]2(C)[C@@]3([H])CC=C4[C@]5([H])C[C@@](C)(C(OC)=O)CC[C@]5(C(=O)O)CC[C@@]4(C)[C@]3(C)CC[C@@]2([H])[C@@](CO)(C)[C@H]1O
|
|
MCULE-2883797701 |
0.73 |
C1(CC2C3=CCC4C5(C(CCC4(C)C3(C)CCC2(C(=O)O)CC1)C(CO)(C)C(O)C(O)C5)C)(C(=O)OC)C
|
|
MCULE-6709791224 |
0.73 |
C1CC2(C)C3C(=O)CC4(C)C(C(CCC(=O)O)=C)CC(O)C4(C)C=3CCC2C(C)(C)C1=O
|
|
MCULE-2519092915 |
0.73 |
C1CCC2(C)C3CCC(C(C)C)=CC3=CCC2C1(C(=O)OC)C
|
|
MCULE-3788851533 |
0.73 |
[C@]12(C)CCC[C@@](C)(C(O)=O)C1CCC1=CC(C(C)C)=CCC12
|
|
MCULE-2582951504 |
0.73 |
C1CC2(C)C(C(O)=O)=CCC2C(C)(C)C1
|
|
MCULE-3588534045 |
0.73 |
C12(C)CCCC(C)(C(O)=O)C1CCC1=CC(C(C)C)=CCC12
|
|
MCULE-1872459490 |
0.73 |
C(C[C@@]1(/C(/CC[C@@]2([H])[C@]3(C)CC[C@]([H])([C@@H](CC/C=C(\C)/C(=O)O)C)[C@@]3(C)CC[C@]21C)=C(\C(O)=O)/C)[H])C(O)=O
|
|
MolPort-001-740-815 |
0.73 |
C[C@@]1(O)CCC[C@]2(C)CC[C@H](C[C@@H]12)C(=C)C(O)=O
|
|
MolPort-035-757-790 |
0.73 |
CC(=O)C1CC2CCC1C=C2
|
|
MolPort-001-740-747 |
0.73 |
CC1(O)CCCC2(C)CCC(CC12)C(=C)C(O)=O
|
|
MolPort-039-338-465 |
0.73 |
C[C@H]1[C@H]2[C@H]3CC[C@@H]4[C@@]5(C)CC[C@H](O)C(C)(C)[C@@H]5CC[C@@]4(C)[C@]3(C)C[C@H](O)[C@@]2(C)CC=C1C
|
|
MolPort-035-706-321 |
0.73 |
CC1(C)[C@H](O)CC[C@]2(C)[C@H]3CC[C@H]4[C@@](C)(CC[C@H]5[C@@](C)(CO)[C@H](O)CC[C@]45C)CC3=CC[C@@H]12
|
|
MolPort-001-762-324 |
0.73 |
OCC1CC2CCC1C=C2
|
|
MolPort-035-706-408 |
0.73 |
CC1(C)CC[C@]2(CO)CC=C3[C@]4(C)CC[C@H]5C(C)(C)[C@@H](O)CC[C@]5(C)[C@H]4CC[C@@]3(C)[C@@H]2C1
|
|
MolPort-044-651-729 |
0.73 |
O=CC1CC2CCC1C=C2
|
|
MolPort-042-620-890 |
0.73 |
O=C[C@@H]1C[C@H]2CC[C@@H]1C=C2
|
|
MolPort-042-621-338 |
0.73 |
OC[C@@H]1C[C@H]2CC[C@@H]1C=C2
|
|
MolPort-020-173-637 |
0.73 |
CC1=CC2CC(C1)CC(=O)C2
|
|
MolPort-002-929-501 |
0.73 |
C[C@]1(O)CCC[C@]2(C)CC[C@H](CC12)C(=C)C(O)=O
|
|
MolPort-046-683-597 |
0.73 |
CC(C)=C1CCC(C)(O)CC1.CC(=C)C1CCC(C)(O)CC1.CC1=CCC(CC1)C(C)(C)O
|
|
MolPort-035-706-405 |
0.73 |
CC1(C)[C@@H](O)CC[C@]2(C)[C@H]3CC[C@H]4[C@@](C)(CC[C@H]5[C@@](C)(CO)[C@@H](O)CC[C@]45C)CC3=CC[C@@H]12
|
|
MolPort-035-706-404 |
0.73 |
CC1(C)[C@H](O)CC[C@]2(C)[C@H]3CC[C@H]4[C@@](C)(CC[C@H]5[C@@](C)(CO)[C@@H](O)CC[C@]45C)CC3=CC[C@@H]12
|
|
MolPort-039-339-016 |
0.73 |
CC(C)=CCC[C@H]([C@H]1CC[C@@]2(C)C3=C(CC[C@]12C)[C@@]1(C)CC[C@H](OC(C)=O)C(C)(C)[C@@H]1CC3)C(O)=O
|
|
MolPort-039-338-222 |
0.73 |
C[C@]1(CCC[C@]2(C)[C@@H]1[C@@H](O)C[C@@]13C[C@@H](CC=C21)C(=C)C3=O)C(O)=O
|
|
MolPort-035-706-393 |
0.73 |
COC(=O)[C@@]1(C)CC[C@@]2(CC[C@]3(C)C(=CC[C@@H]4[C@@]5(C)C[C@H](O)[C@H](O)[C@@](C)(CO)[C@@H]5CC[C@@]34C)[C@@H]2C1)C(O)=O
|
|
MolPort-044-637-463 |
0.73 |
CC(C)=CCCC(C1CCC2(C)C3=C(CCC12C)C1(C)CCC(OC(C)=O)C(C)(C)C1CC3)C(O)=O
|
|
MolPort-046-153-146 |
0.73 |
CC12CC(=O)C3=C(CCC4C(C)(C)C(=O)CCC34C)C1(C)C(O)CC2C(=C)CCC(O)=O
|
|
MolPort-006-110-824 |
0.73 |
COC(=O)[C@]1(C)CCC[C@]2(C)[C@H]3CCC(=CC3=CC[C@@H]12)C(C)C
|
|
MolPort-044-183-243 |
0.73 |
CCCC1(CCC1)[C@@H](O)C\C=C\[C@H]1[C@H](O)CC(=O)[C@@H]1CCCCCCC(O)=O
|
|
MolPort-045-901-862 |
0.73 |
CC(C)C1=CCC2C(CCC3C2(C)CCCC3(C)C(O)=O)=C1
|
|
MolPort-046-647-049 |
0.73 |
OC(=O)C1=C[C@@H]2CCCC[C@H]12
|
|
MolPort-044-183-126 |
0.73 |
CCCCCC(=O)CC[C@@H]1[C@@H](C\C=C/CCCC(O)=O)C=CC1=O
|
|
MolPort-002-511-643 |
0.73 |
CC(C)C1=CCC2C(CCC3[C@]2(C)CCC[C@@]3(C)C(O)=O)=C1
|
|
MolPort-009-018-970 |
0.73 |
CCCC1(CCC1)[C@H](O)C\C=C\[C@H]1C(O)CC(=O)C1CCCCCCC(O)=O
|
|
MolPort-019-937-489 |
0.73 |
CC12CCCC(C)(C)C1CC=C2C(O)=O
|
|
MolPort-039-052-429 |
0.73 |
C[C@H](CC\C=C(/C)C(O)=O)[C@H]1CC[C@@]2(C)[C@@H]3CC\C([C@@H](CCC(O)=O)[C@]3(C)CC[C@]12C)=C(/C)C(O)=O
|
|
MolPort-001-787-763 |
0.73 |
OC(=O)CC1CCC=C1
|
|
MolPort-000-733-209 |
0.72 |
CC(=O)C1CC[C@@]2(O)C3=CC(=O)C4CC(O)C(O)CC4(C)C3CCC12C
|
|
MolPort-005-945-088 |
0.72 |
C[C@@H]1CC[C@@]2(CC[C@]3(C)C(=CCC4[C@@]5(C)[C@@H](O)[C@@H](O)[C@H](O)C(C)(C)C5CC[C@@]34C)C2[C@]1(C)O)C(O)=O
|
|
MolPort-039-338-961 |
0.72 |
C[C@H](CC(O)C=C(C)C)[C@H]1CC[C@@]2(C)[C@@H]3[C@@H](O)C=C4[C@@H](CC[C@H](O)C4(C)C)[C@@]3(CC[C@]12C)C=O
|
|
MolPort-035-705-880 |
0.72 |
CC1(C)[C@H]2C[C@@H](O)[C@@]34[C@H](O)[C@@H](CC[C@H]3[C@]2(C)C=CC1=O)C(=C)C4=O
|
|
MolPort-035-705-838 |
0.72 |
CC(C)C1=CC(=O)C2=C(CC[C@H]3[C@@](C)(CO)C(=O)CC[C@]23C)C1=O
|
|
MolPort-046-693-183 |
0.72 |
C[C@]12C[C@H](O)[C@H]3[C@@H](CCC4=CC(=O)CC[C@]34C)[C@@H]1CC[C@]2(O)C(O)=O
|
|
MolPort-046-790-470 |
0.72 |
C[C@H](C\C=C\C(C)(C)O)[C@H]1CC[C@@]2(C)[C@@H]3[C@@H](O)C=C4[C@@H](CC[C@H](O)C4(C)C)[C@@]3(CC[C@]12C)C=O
|
|
MolPort-035-706-463 |
0.72 |
C[C@@H]1CC[C@@]2(CC[C@]3(C)C(=CC[C@@H]4[C@@]5(C)[C@H](O)C(=O)[C@H](O)C(C)(C)[C@@H]5CC[C@@]34C)[C@@H]2[C@]1(C)O)C(O)=O
|
|
MolPort-039-338-104 |
0.72 |
C[C@@H]1CC[C@@]2(CC[C@]3(C)C(=CC[C@@H]4[C@@]5(C)[C@H](O)[C@@H](O)[C@H](O)C(C)(C)[C@@H]5CC[C@@]34C)[C@@H]2[C@]1(C)O)C(O)=O
|
|
MolPort-039-338-612 |
0.72 |
C[C@@H]1CC[C@@]2(CC[C@]3(C)C(=CC[C@@H]4[C@@]5(C)[C@H](O)[C@@H](O)[C@@H](O)C(C)(C)[C@@H]5CC[C@@]34C)[C@@H]2[C@]1(C)O)C(O)=O
|
|
MolPort-002-525-832 |
0.72 |
CC(=O)[C@H]1CC[C@@]2(O)C3=CC(=O)[C@@H]4C[C@@H](O)[C@@H](O)C[C@]4(C)C3CC[C@]12C
|
|
MolPort-039-338-124 |
0.72 |
C[C@H](CC(=O)CC(C)C(O)=O)[C@H]1CC(O)[C@@]2(C)C3=C(C(=O)C[C@]12C)[C@@]1(C)CCC(=O)C(C)(C)C1CC3
|
|
MolPort-023-279-066 |
0.72 |
COC(=O)[C@]12CCC(C)(C)C[C@@H]1[C@H]1C(=O)C=C3[C@@]4(C)CCC(=O)C(C)(C)C4CC[C@@]3(C)[C@]1(C)CC2
|
|
MolPort-044-649-708 |
0.72 |
CC1(C)CC[C@@]2(CC[C@]3(C)C(=CC[C@@H]4[C@@]5(C)C=C(O)C(=O)C(C)(C)[C@@H]5CC[C@@]34C)[C@@H]2C1)C(O)=O
|
|
MolPort-005-943-996 |
0.72 |
C[C@H]1[C@H](O)CCC2=CC(=O)C(C[C@]12C)=C(C)C
|
|
MolPort-029-870-265 |
0.72 |
OC(=O)CC1CC=CC1
|
|
MolPort-002-509-792 |
0.72 |
C[C@]12CCC3[C@@H](CC[C@H]4CC=CC[C@]34C)C1CCC2=O
|
|
MolPort-044-637-544 |
0.72 |
C[C@@H]1CC[C@]2(C)CC[C@]3(C)C(=CCC4[C@@]5(C)CC[C@@H](O)[C@](C)(CO)C5CC[C@@]34C)[C@@H]2[C@H]1C
|
|
MolPort-046-762-299 |
0.72 |
C[C@]12CC[C@@H]3[C@@H](CC[C@@H]4CC=CC[C@]34C)[C@H]1CCC2=O
|
|
MolPort-007-980-904 |
0.72 |
CC(=C)C1CCC2(CC[C@]3(C)C(CCC4[C@@]5(C)CCC(O)C(C)(C)C5CC[C@@]34C)C12)C=O
|
|
MolPort-046-674-687 |
0.72 |
O=C1CC2CC=CCC2C1
|
|
MolPort-039-052-639 |
0.72 |
CC1(C)CC[C@]2(C)CC[C@]3(C)C(=CC[C@@H]4[C@@]5(C)CC[C@H](O)[C@](C)(CO)[C@@H]5CC[C@@]34C)[C@@H]2C1
|
|
MolPort-027-637-299 |
0.72 |
CC(=C)[C@@H]1CC[C@@]2(CC[C@]3(C)[C@H](CC[C@@H]4[C@@]5(C)CC[C@H](O)C(C)(C)[C@@H]5CC[C@@]34C)[C@@H]12)C=O
|
|
MolPort-046-764-451 |
0.72 |
[2H]C([2H])([2H])C([2H])([2H])[C@]1(O)CC[C@H]2[C@@H]3CCC4=CCCC[C@@H]4[C@H]3CC[C@]12C
|
|
MolPort-002-911-100 |
0.72 |
CC12CCC3C(CCC4=CCCCC34)C1CCC2O
|
|
MolPort-002-911-107 |
0.72 |
CC12CCC3C(CCC4=CCCCC34)C1CCC2=O
|
|
MolPort-005-932-642 |
0.72 |
C[C@]12CC[C@H]3[C@@H](CC[C@H]4CC=CC[C@]34C)[C@@H]1CCC2=O
|
|
MolPort-046-690-337 |
0.72 |
C[C@]1(O)CC[C@H]2[C@@H]3CC[C@H]4CC=CC[C@]4(C)[C@H]3CC[C@]12C
|
|
MolPort-046-596-343 |
0.72 |
C[C@]12CCC3C(CC[C@H]4CC=CC[C@]34C)C1CCC2=O
|
|
MolPort-020-007-892 |
0.72 |
C[C@]12CC[C@H]3[C@@H](CCC4CC=CC[C@]34C)[C@@H]1CCC2=O
|
|
MolPort-027-641-344 |
0.72 |
CC\C=C/C[C@H]1[C@@H](CCCCCC(O)=O)C=CC1=O
|
|
MolPort-001-739-472 |
0.72 |
CCCCC\C=C/C\C=C/C(O)CCCCCCC(O)=O
|
|
MolPort-004-801-991 |
0.72 |
CC1(C)CCC=C(C1)C(O)=O
|
|
MolPort-039-239-507 |
0.72 |
CC1(C)CCC(=CC1)C(O)=O
|
|
MolPort-039-060-935 |
0.72 |
CC1=C(CCC(C)(C)C1)C(O)=O
|
|
MolPort-046-765-492 |
0.72 |
OCC\C=C/CC1C(CC(O)=O)CCC1=O
|
|
MolPort-006-394-496 |
0.72 |
OC(CCCCCC\C=C/CCCCCCC#C)C(O)=O
|
|
MolPort-019-904-832 |
0.72 |
CC1CCC(=CC1)C(O)=O
|
|
MolPort-023-274-284 |
0.72 |
CC\C=C/C[C@@H]1[C@@H](CCCCCCCC(O)=O)C=CC1=O
|
|
MolPort-006-668-478 |
0.72 |
OCC\C=C/C[C@@H]1[C@@H](CC(O)=O)CCC1=O
|
|
MolPort-001-741-222 |
0.72 |
CC\C=C/CC(O)C(O)CCC(O)CCCCCCCC(O)=O
|
|
MCULE-3490312737 |
0.72 |
C/C(/C)=C\CC1(C(O)=O)CC2(CCC2)C1
|
|
MCULE-6401226702 |
0.72 |
CC=CC(C1(CCCCC1)O)=O
|
|
MCULE-7136534003 |
0.72 |
CC=CCC1(C(O)=O)CC2(CCC2)C1
|
|
MCULE-4926555419 |
0.72 |
C1C(C)C(C(O)=O)/C(=C(/C)\C)/C1
|
|
MCULE-1652773504 |
0.72 |
C1(/CCC(C/1)C(O)=O)=C(\C)/C
|
|
MCULE-3773650223 |
0.72 |
C1C[C@]2(C)C3C(=O)C=C(C(C)C)C(=O)C=3CC[C@@]2([H])[C@@](C)(CO)C1=O
|
|
MCULE-8942246758 |
0.72 |
C1(C(O)=O)CC(=O)/C(=C(/C2CC2)\O)/C(=O)C1
|
|
MCULE-6478033386 |
0.72 |
[C@@H]1(O)[C@H](O)[C@@]2(C3CC=C4C5[C@@](O)(C)[C@H](C)CC[C@]5(C(O)=O)CC[C@@]4(C)[C@]3(C)CCC2C([C@H]1O)(C)C)C
|
|
MCULE-4351701102 |
0.72 |
C12=CC(=O)C3C(C)(CC(C(O)C3)O)C1CCC1(C)C(CC[C@@]21O)C(C)=O
|
|
MCULE-3727435032 |
0.72 |
C(O)(C1=CCC2C1(C)CCC1C2CC=C2CC(O)CCC21C)=O
|
|
MCULE-6355846723 |
0.72 |
C1CC2=CC(=O)/C(/C[C@]2(C)[C@H]([C@@H]1O)C)=C(\C)/C
|
|
MCULE-8109491654 |
0.72 |
[C@]12(C)CC[C@H]3[C@@]([H])(CC[C@@]4([H])CC=CC[C@]34C)[C@@H]1CCC2=O
|
|
MCULE-8989542766 |
0.72 |
C12C3C(C4(C)C(CC3)CC(=O)CC4)CCC=1C(CC2)(C)C
|
|
MCULE-2484766562 |
0.72 |
C1C[C@@]2([C@]3(CC[C@@]4([C@]5([C@H](C(C)=C)CC[C@]5(C=O)CC[C@@]4(C)[C@]3(C)CC[C@@]2([H])C(C)(C)[C@H]1O)[H])[H])[H])C
|
|
MCULE-5596219960 |
0.72 |
O=C(C1C2(CC2)C1)CC1CC=CCC1
|
|
MCULE-1648678126 |
0.72 |
CC1C(C(CC2CC=CCC2)=O)C1
|
|
MCULE-3080370181 |
0.72 |
C1CC2(CC(=O)CC2(C)CC=1)C
|
|
MCULE-1095982134 |
0.72 |
[H]C12CC(O)CCC1(C)C1C=CC3(C)C(CCC3C(C)CCCO)C1CC2
|
|
MCULE-4823416344 |
0.72 |
CC(C1(CC1)CC1C2C=CC(CC2)C1)=O
|
|
MCULE-4409286429 |
0.72 |
O=C1CCC2(C)C1(CCC1(C)C3(C)CCC4(C)CCC(C)(C)CC4(C3=CCC21)[H])[H]
|
|
MCULE-1753922453 |
0.72 |
[H][C@@]12[C@]3(CC[C@]4([C@](C)([C@]3(C)CC[C@@]1(C=O)CC[C@H]2C(=C)C)CC[C@]1([H])[C@@]4(CC[C@@H](C1(C)C)O)C)[H])[H]
|
|
MCULE-5588914917 |
0.72 |
O=CC1(CCC1)CC1C2C=CC(CC2)C1
|
|
MCULE-4780950529 |
0.72 |
[H]C12CCCC=C1CCC1C3CCC(O)C3(C)CCC21
|
|
MCULE-5966520622 |
0.72 |
C1C[C@@]2([H])[C@](C)(CC=1)[C@]1([H])[C@]([H])([C@@]3([H])[C@@](CC1)(C)C(=O)CC3)CC2
|
|
MCULE-9756913466 |
0.72 |
C12CCC3=CCCCC3C1CCC1(C)C(CCC21)=O
|
|
MCULE-8573249352 |
0.72 |
[H]C12CC=CCC1(C)C1CCC3(C)C(CCC3C1CC2)C(C)=O
|
|
MCULE-6078845553 |
0.72 |
CC1CC(C(CC2CC=CCC2)=O)C1
|
|
MCULE-3814030883 |
0.72 |
[C@]12(C)CCC3[C@@]([H])(CC[C@@]4([H])CC=CC[C@]34C)C1CCC2=O
|
|
MCULE-4126238786 |
0.72 |
O=CC1(CC1)CC1C2C=CC(CC2)C1
|
|
MCULE-1038909539 |
0.72 |
C1C[C@]2(C)C3CC=C4[C@]5([H])[C@@H](C)[C@H](C)CC[C@]5(C)CC[C@@]4(C)[C@]3(C)CCC2[C@](CO)(C)[C@@H]1O
|
|
MCULE-8432152948 |
0.72 |
CC1(C(CC2CC=CCC2)=O)CC1
|
|
MCULE-7944143685 |
0.72 |
O=C(C1CC1)CC1CC=CCC1
|
|
MCULE-5790792765 |
0.72 |
O=C1C(CC2C3C=CC(CC3)C2)CCC1
|
|
MCULE-5954084349 |
0.72 |
CC(C(CC1CC=CCC1)O)(O)C
|
|
MCULE-3227878705 |
0.72 |
[H]C12CC=CCC1(C)C1CCC3(C)C(CCC3C1CC2)=O
|
|
MCULE-6337171250 |
0.72 |
[C@]12(C)CC[C@]3([C@@]([H])(CC[C@@]4([H])CC=CC[C@]34C)[C@]1([H])CC[C@@H]2C(C)=O)[H]
|
|
MCULE-7487706695 |
0.72 |
CC1(C(C(CC2CC=CCC2)=O)C1)C
|
|
MCULE-3236832984 |
0.72 |
C12(C)C(C(C)CCCO)CCC1C1C(CC2)C2(CCCCC2C=C1)C
|
|
MCULE-5661083032 |
0.72 |
CC1C(C(CC2CC=CCC2)=O)CCC1
|
|
MCULE-7994229276 |
0.72 |
O=C(C1CCC1)CC1CC=CCC1
|
|
MCULE-4014926214 |
0.72 |
CC1CC(C(CC2CC=CCC2)=O)CC1
|
|
MCULE-8650890619 |
0.72 |
CC1(C(C(CC2CC=CCC2)O)C1)C
|
|
MCULE-1842062313 |
0.72 |
CC1(C(CC2CC=CCC2)=O)CCCC1
|
|
MCULE-8147130899 |
0.72 |
C(CCCCCC(=O)O)C(/C=C\C/C=C\CCCCC)O
|
|
MCULE-8251556719 |
0.72 |
[C@H]1(C/C=C\CCO)C(CC[C@@H]1CC(=O)O)=O
|
|
MCULE-9922742805 |
0.72 |
C(C)/C=C\CC(O)C(O)CCC(CCCCCCCC(O)=O)O
|
|
MCULE-8346653877 |
0.72 |
CC1CC(C)(C)CCC=1C(=O)O
|
|
MCULE-9935430898 |
0.72 |
C(C(CCCCCC)CC=CCCCCCCCC(OC)=O)(C)=O
|
|
MCULE-3161766037 |
0.72 |
C(O)(C1=CCCCCCCCCC1)=O
|
|
MCULE-3209954130 |
0.72 |
C1[C@@H](CC[C@]2(CC[C@H](O)[C@]21C(=O)C)C)C(C(O)=O)=C
|
|
MCULE-9255224968 |
0.72 |
C(O)(=O)CCCC=CCC=CCC=CCC=CCC=CCC
|
|
MCULE-7694867483 |
0.72 |
CC/C=C\C/C=C\C/C=C\C/C=C\C/C=C\CCCC(=O)O
|
|
MCULE-7916341231 |
0.72 |
[C@]12(C)CCCC(=O)[C@]1([H])CC[C@@H]2[C@H](C)/C=C/[C@H](C)C(C)(C)O
|
|
MCULE-6879064173 |
0.72 |
C12C[C@@H](CC[C@H](C)[C@]1([H])CC(=O)C=2C)C(=C)C(O)=O
|
|
MCULE-3304274375 |
0.72 |
C12=CCC(C)C1CC1(O)C(C)(CO)C2(C)CC1=O
|
|
MCULE-7832981899 |
0.72 |
C(OC)(=O)C1CCC(=CC1)C
|
|
MCULE-2022303549 |
0.72 |
C1(=O)CCC2(C)C3C(O)CC4(C=O)C(C(CO)=O)CCC4C3CCC2=C1
|
|
MCULE-8953627920 |
0.72 |
[C@]12(C)C[C@H](O)[C@]3([C@@]([H])(CCC4=CC(=O)CC[C@]34C)[C@]1([H])CC[C@]2(O)C(CO)=O)[H]
|
|
MCULE-5186769141 |
0.72 |
C12(C)C[C@H](O)C3C(CCC4=CC(=O)CCC34C)C1C[C@@H](C)[C@]2(O)C(CO)=O
|
|
MCULE-8463642691 |
0.72 |
C1C[C@]2(C)[C@@]3([H])[C@@H](O)C[C@]4(C)[C@@](O)(C(CO)=O)CC[C@@]4([H])[C@]3([H])CCC2=CC1=O
|
|
MCULE-4822409054 |
0.72 |
C12(C)C[C@@H](O)C3C(CCC4=CC(=O)CCC34C)C1CC[C@]2(O)C(CO)=O
|
|
MCULE-4398945581 |
0.72 |
C12(C)CC(=O)C3C(CCC4=CC(=O)CCC34C)C1CCC2(O)C(CO)=O
|
|
MCULE-7299298141 |
0.72 |
[C@]12(C)CC(=O)[C@]3([C@@]([H])(CCC4=CC(=O)CC[C@]34C)[C@]1([H])CC[C@]2(O)C(CO)=O)[H]
|
|
MCULE-1512611020 |
0.72 |
Cl.NC(C(O)=O)C1CC=CCC1
|
|
MCULE-6215568256 |
0.72 |
[C@@H]1(O)C[C@@]2(C3CC=C4C5[C@@](O)(C)[C@H](C)CC[C@]5(C(O)=O)CC[C@@]4(C)[C@]3(C)CCC2[C@@]([C@H]1O)(CO)C)C
|
|
MCULE-8646276663 |
0.72 |
C12(C)CC(O)C3C(CCC4=CC(=O)CCC34C)C1CCC2(O)C(CO)=O
|
|
MCULE-3935898183 |
0.72 |
C1(=O)C=C2[C@](C)(CC1)[C@]1([H])[C@]([H])([C@@]3([H])[C@@](CC1=O)(C)[C@@](O)(C(=O)CO)CC3)CC2
|
|
MCULE-2655341532 |
0.72 |
C1CC2(C3CC=C4C5C(O)(C)C(C)CCC5(C(O)=O)CCC4(C)C3(C)CCC2C(C1O)(C(O)=O)C)C
|
|
MCULE-7920901589 |
0.72 |
C1C(C(=O)OC)(C)CC(C)=C(C)C1
|
|
MCULE-9540409196 |
0.72 |
C1C[C@@]2(C3CC=C4C5[C@@](O)(C)[C@H](C)CC[C@]5(C(O)=O)CC[C@@]4(C)[C@]3(C)CCC2[C@]([C@H]1O)(C(O)=O)C)C
|
|
MCULE-8839185629 |
0.72 |
N#C[C@H]1[C@H](C(=O)C)[C@]2(C)[C@@]([C@]3([C@@](CC2)([H])[C@]2(C)C(C[C@H](CC2)O)=CC3)[H])([H])C1
|
|
MCULE-2791131855 |
0.72 |
[C@]12(C)C[C@H](O)[C@]3([C@@]([H])(CCC4=CC(=O)CC[C@]34C)[C@]1([H])C[C@@H](C)[C@]2(O)C(CO)=O)[H]
|
|
MCULE-7803183347 |
0.72 |
O[C@@H]1[C@](CO)(C)C2[C@](C3CC=C4[C@]5([H])[C@H](O)C(C)(C)CC[C@]5(C(O)=O)CC[C@]4([C@]3(C)CC2)C)(C)C[C@H]1O
|
|
MCULE-7321817046 |
0.72 |
CC1([C@@]2(CCC(C(=O)O)=CC2)C(=C)CCC1)C
|
|
MCULE-2445362476 |
0.72 |
C12=CC(CCC1(C)C1C(C3CCC(O)(C(C)=O)C3(CC1)C)CC2=C)=O
|
|
MCULE-9921246997 |
0.72 |
O[C@H]1C[C@]2(C=O)[C@@H](C(CO)=O)CC[C@H]2[C@@H]2CCC3=CC(CC[C@]3(C)[C@H]21)=O
|
|
MCULE-6325385060 |
0.72 |
[C@]12(C)CC[C@]3([C@@]([H])(CCC4=CC(=O)CCC43)[C@]1([H])CC[C@]12CO1)[H]
|
|
MCULE-4114109251 |
0.72 |
C12C3C4C5C3C1C(C(=O)O)=C(C(=O)O)C5C24
|
|
MCULE-5480996294 |
0.72 |
O=C1CCC2(C)C3CCC4(C)C(O)(CCC4C3CC(O)C2=C1)C(CO)=O
|
|
MolPort-003-933-180 |
0.72 |
CC\C=C/C\C=C/C\C=C/C\C=C/C\C=C/CCCC(O)=O
|
|
MolPort-001-740-812 |
0.72 |
CC(=O)[C@]12C[C@@H](CC[C@@]1(C)CC[C@@H]2O)C(=C)C(O)=O
|
|
MolPort-006-113-596 |
0.72 |
COC(=O)[C@]12CCC(C)(C)C[C@H]1C1=CC[C@@H]3[C@@]4(C)CC[C@H](O)C(C)(C)[C@@H]4CC[C@@]3(C)[C@]1(C)CC2
|
|
MolPort-021-804-587 |
0.72 |
CC1CCC2(CCC3(C)C(=CCC4C5(C)C[C@@H](O)[C@@H](O)C(C)(CO)C5CCC34C)C2C1(C)O)C(O)=O
|
|
MolPort-002-932-776 |
0.72 |
CC12CC(=O)C3C(CCC4=CC(=O)CCC34C)C1CCC2(O)C(=O)CO
|
|
MolPort-000-713-768 |
0.72 |
CC12C[C@@H](O)C3C(CCC4=CC(=O)CCC34C)C1CC[C@]2(O)C(=O)CO
|
|
MolPort-046-509-005 |
0.72 |
CC1(C)CC[C@@]2(CC[C@]3(C)C(=CC[C@@H]4[C@@]5(C)C[C@@H](O)[C@H](O)[C@@](C)(CO)[C@@H]5CC[C@@]34C)[C@@H]2[C@@H]1O)C(O)=O
|
|
MolPort-019-949-553 |
0.72 |
C[C@@H]1C[C@H]2[C@@H]3CCC4=CC(=O)CC[C@]4(C)[C@H]3[C@@H](O)C[C@]2(C)[C@@]1(O)C(=O)CO
|
|
MolPort-021-804-637 |
0.72 |
CC1CC=C2C1CC1(O)C(=O)CC2(C)C1(C)CO
|
|
MolPort-006-131-902 |
0.72 |
C[C@]12C[C@@H](O)[C@H]3[C@@H](CCC4=CC(=O)CC[C@]34C)[C@@H]1CC[C@]2(O)C(=O)CO
|
|
MolPort-006-130-833 |
0.72 |
COC(=O)C1(C)CCC(C)=CC1
|
|
MolPort-046-158-545 |
0.72 |
C[C@@H]1CC[C@@]2(CC[C@]3(C)C(=CC[C@@H]4[C@@]5(C)C[C@@H](O)[C@H](O)[C@@](C)(CO)[C@@H]5CC[C@@]34C)[C@@H]2[C@]1(C)O)C(O)=O
|
|
MolPort-001-742-450 |
0.72 |
C[C@H]1CC[C@H](CC2=C(C)C(=O)C[C@@H]12)C(=C)C(O)=O
|
|
MolPort-006-069-316 |
0.72 |
C[C@]12CCC(=O)C=C1CC[C@H]1[C@@H]3CC[C@H](C(=O)CO)[C@]3(C[C@H](O)[C@H]21)C=O
|
|
MolPort-006-126-442 |
0.72 |
COC(=O)[C@]12CC[C@@H](C)[C@H](C)[C@H]1C1=CC[C@@H]3[C@@]4(C)CC[C@H](O)C(C)(C)[C@@H]4CC[C@@]3(C)[C@]1(C)CC2
|
|
MolPort-002-529-087 |
0.72 |
C[C@]12CC(=O)[C@H]3[C@@H](CCC4=CC(=O)CC[C@]34C)[C@@H]1CC[C@]2(O)C(=O)CO
|
|
MolPort-046-683-789 |
0.72 |
[2H]C1([2H])[C@]([2H])(O)[C@@]2([2H])[C@@H](CCC3=CC(=O)CC[C@]23C)[C@@H]2CC[C@](O)(C(=O)CO)[C@@]12C
|
|
MolPort-046-596-366 |
0.72 |
CC(=O)[C@@]1(O)CCC2C3CC(=C)C4=CC(=O)CC[C@]4(C)C3CC[C@]12C
|
|
MolPort-002-529-268 |
0.72 |
C[C@]12CC[C@H]3[C@@H](CCC4=CC(=O)CCC34)[C@@H]1CC[C@@]21CO1
|
|
MolPort-035-924-387 |
0.72 |
CC12CCC(=O)C=C1CCC1C3CCC(C(=O)CO)C3(CC(O)C21)C=O
|
|
MolPort-046-766-234 |
0.72 |
C[C@]12CCC(=O)C=C1CC[C@H]1[C@@H]3CC[C@H](C(=O)CO)[C@]3(C[C@H](O)C21)C=O
|
|
MolPort-002-157-619 |
0.72 |
CC12CC(O)C3C(CCC4=CC(=O)CCC34C)C1CCC2(O)C(=O)CO
|
|
MolPort-006-668-670 |
0.72 |
CC1CCC2(CCC3(C)C(=CCC4C5(C)CCC(O)C(C)(C5CCC34C)C(O)=O)C2C1(C)O)C(O)=O
|
|
MolPort-002-054-310 |
0.72 |
Cl.N[C@@H]1CC\C=C/CC[C@@H]1C(O)=O
|
|
MolPort-044-755-245 |
0.72 |
CO[C@H]1CC[C@]2(C)[C@H]3CC[C@@]4(C)[C@@H](CC[C@@H]4C(=O)C(C)C)[C@@H]3CC=C2C1
|
|
MolPort-002-176-715 |
0.72 |
CC(=O)C1(O)CCC2C3CC(=C)C4=CC(=O)CCC4(C)C3CCC12C
|
|
MolPort-046-693-022 |
0.72 |
CC[C@]12CC[C@H]3[C@@H](CC=C4CC(=O)CC[C@H]34)[C@@H]1CC[C@@]2(O)C#C
|
|
MolPort-006-668-441 |
0.72 |
CC1(C)CCCC(=C)C11CCC(=CC1)C(O)=O
|
|
MolPort-001-741-316 |
0.72 |
CC1(C)CC[C@@]2(CC[C@]3(C)C(=CCC4[C@@]5(C)C[C@@H](O)[C@H](O)C(CO)(CO)C5CC[C@@]34C)C2[C@@H]1O)C(O)=O
|
|
MolPort-001-741-276 |
0.72 |
CC1(C)CC[C@@]2(CC[C@]3(C)C(=CCC4[C@@]5(C)C[C@@H](O)[C@H](O)[C@@](C)(CO)C5CC[C@@]34C)[C@@H]2[C@@H]1O)C(O)=O
|
|
MolPort-002-054-309 |
0.72 |
Cl.N[C@H]1CC\C=C/CC[C@H]1C(O)=O
|
|
MolPort-046-793-261 |
0.72 |
C[C@]12CC[C@H]3[C@@H](C[C@H](O)C4=CC(=O)CC[C@]34C)[C@@H]1CC[C@]2(O)C(=O)CO
|
|
MolPort-002-622-310 |
0.72 |
NCC1CC2CC1C=C2.OC(=O)C1C[C@H]2CC[C@@H]1C2
|
|
MolPort-044-755-253 |
0.72 |
C[C@]12C[C@H](O)[C@H]3[C@@H](CCC4=CC(=O)CC[C@]34C)[C@@H]1CC[C@]2(O)C(O)CO
|
|
MolPort-006-712-929 |
0.72 |
COC(=O)C1CCC(C)=CC1
|
|
MolPort-023-279-448 |
0.72 |
C[C@@H]1CC2C3CCC4=CC(=O)CCC4(C)C3[C@@H](O)CC2(C)[C@@]1(O)C(=O)CO
|
|
MolPort-007-980-854 |
0.72 |
CC12CC(=O)C3C(CCC4=CC(=O)CCC34C)C1CC[C@]2(O)C(=O)CO
|
|
MolPort-001-794-637 |
0.72 |
C[C@]12C[C@H](O)[C@H]3[C@@H](CCC4=CC(=O)CC[C@]34C)[C@@H]1CC[C@]2(O)C(=O)CO
|
|
MolPort-044-649-592 |
0.72 |
COC(=O)[C@]12CC[C@@H](C)[C@H](C)[C@H]1C1=CC[C@@H]3[C@@]4(C)CCC(=O)C(C)(C)[C@@H]4CC[C@@]3(C)[C@]1(C)CC2
|
|
MolPort-001-741-329 |
0.72 |
CC1(C)CC[C@@]2(CC[C@]3(C)C(=CCC4[C@@]5(C)C[C@@H](O)[C@H](O)[C@](C)(CO)C5CC[C@@]34C)[C@@H]2[C@@H]1O)C(O)=O
|
|
MolPort-046-687-749 |
0.72 |
Cl.NC(C1CCC=CC1)C(O)=O
|
|
MolPort-001-741-354 |
0.72 |
C[C@@H]1CC[C@@]2(CC[C@]3(C)C(=CCC4[C@@]5(C)CC[C@H](O)[C@@](C)(C5CC[C@@]34C)C(O)=O)C2[C@]1(C)O)C(O)=O
|
|
MolPort-046-765-489 |
0.72 |
CC[C@]12CC[C@@H]3[C@@H](CC=C4CC(=O)CC[C@H]34)[C@H]1CCC2(O)C#C
|
|
MolPort-046-793-262 |
0.72 |
C[C@]12CC[C@H]3[C@@H](C[C@@H](O)C4=CC(=O)CC[C@]34C)[C@@H]1CC[C@]2(O)C(=O)CO
|
|
MolPort-006-113-487 |
0.72 |
C[C@H]1C[C@H]2[C@@H]3CC[C@](O)(C(=O)CO)[C@@]3(C)C[C@H](O)[C@@H]2[C@@]2(C)CCC(=O)C=C12
|
|
MolPort-005-944-635 |
0.72 |
C[C@@H]1CC[C@@]2(CC[C@]3(C)C(=CCC4[C@@]5(C)C[C@@H](O)[C@H](O)[C@@](C)(CO)C5CC[C@@]34C)C2[C@]1(C)O)C(O)=O
|
|
MolPort-003-959-137 |
0.72 |
CC(=O)[C@H]1[C@@H](C[C@H]2[C@@H]3CC=C4C[C@@H](O)CC[C@]4(C)[C@H]3CC[C@]12C)C#N
|
|
MolPort-046-766-226 |
0.72 |
C[C@]12CCC(=O)C=C1CC[C@H]1[C@@H]3CC[C@@](O)(C3C[C@@H](O)C21)C(=O)CO
|
|
MolPort-006-391-847 |
0.72 |
[2H]C1=C2C([2H])([2H])C[C@H]3[C@@H]4CC[C@H](C(=O)C([2H])([2H])O)[C@]4(C[C@H](O)[C@@H]3[C@@]2(C)CC([2H])([2H])C1=O)C=O
|
|
MolPort-002-524-912 |
0.72 |
COC(=O)[C@]12CC[C@@H](C)[C@H](C)[C@H]1C1=CCC3[C@@]4(C)CC[C@@H](O)C(C)(C)C4CC[C@@]3(C)[C@]1(C)CC2
|
|
MolPort-006-393-332 |
0.72 |
[2H]C1([2H])[C@]([2H])(O)C2([2H])[C@@H](CCC3=CC(=O)CC[C@]23C)C2CCC(O)(C(=O)CO)[C@@]12C
|
|
MolPort-002-510-100 |
0.72 |
CC(=O)[C@@]1(O)CCC2[C@@H]3CC(=C)C4=CC(=O)CC[C@]4(C)C3CC[C@]12C
|
|
MolPort-044-649-704 |
0.72 |
COC(=O)[C@]12CCC(C)(C)C[C@H]1C1=CC[C@@H]3[C@@]4(C)CCC(=O)C(C)(C)[C@@H]4CC[C@@]3(C)[C@]1(C)CC2
|
|
MolPort-046-158-410 |
0.72 |
C[C@@H]1CC[C@@]2(CC[C@]3(C)C(=CC[C@@H]4[C@@]5(C)C[C@@H](O)[C@@H](O)[C@@](C)(CO)[C@@H]5CC[C@@]34C)[C@@H]2[C@]1(C)O)C(O)=O
|
|
MolPort-035-706-318 |
0.71 |
CC1(C)[C@@H](O)CC[C@]2(C)[C@@H](CC[C@H]3C(=O)CC[C@H]4C(C)(C)[C@@H](O)CC[C@]34C)C(=C)CC[C@@H]12
|
|
MolPort-002-894-354 |
0.71 |
OC(=O)CCCCCCCC(=O)CCCCCCCCC=C
|
|
MolPort-002-511-836 |
0.71 |
CC(O)CC[C@]1(C)CCC(C)=CC1C
|
|
MolPort-002-507-443 |
0.71 |
CCC(O)CCC1(C)CCC(C)=CC1C
|
|
MolPort-000-153-810 |
0.71 |
OC(=O)CCCCCCCC=C
|
|
MolPort-001-783-148 |
0.71 |
OC(=O)[C@H]1CC=CC[C@H]1C(O)=O
|
|
MolPort-001-789-840 |
0.71 |
OC(=O)[C@@H]1CC=CC[C@H]1C(O)=O
|
|
MolPort-025-497-618 |
0.71 |
CC(C)CC(CCC=C)C(O)=O
|
|
MolPort-002-511-854 |
0.71 |
CCC(O)CC[C@]1(C)CCC(C)=CC1C
|
|
MolPort-000-860-879 |
0.71 |
OC(=O)C1CC=CCC1C(O)=O
|
|
MolPort-039-338-127 |
0.71 |
C[C@H](CC(=O)CC(C)C(O)=O)[C@H]1CC(=O)[C@@]2(C)C3=C(C(=O)C[C@]12C)[C@@]1(C)CC[C@H](O)C(C)(C)C1CC3=O
|
|
MolPort-023-213-102 |
0.71 |
CC(=C)CCCCCCC(O)=O
|
|
MolPort-006-069-065 |
0.71 |
OC(=O)CCCCCCCCCC=C
|
|
MolPort-023-213-101 |
0.71 |
CC(=C)CCCCCC(O)=O
|
|
MolPort-023-213-100 |
0.71 |
CC(=C)CCCCC(O)=O
|
|
MolPort-023-213-093 |
0.71 |
OC(=O)CCCCCCC=C
|
|
MolPort-023-213-092 |
0.71 |
OC(=O)CCCCCC=C
|
|
MolPort-022-365-502 |
0.71 |
CC(=C)CCCC(O)=O
|
|
MolPort-044-729-335 |
0.71 |
OCC1CCC\C=C/CC1
|
|
MolPort-028-746-650 |
0.71 |
OC(=O)CCCCCCCCCCCCC=C
|
|
MolPort-002-507-392 |
0.71 |
OC(=O)CCCCCCCCC=C
|
|
MolPort-027-640-976 |
0.71 |
CCCCC[C@H](O)\C=C\[C@H]1[C@H](O)C[C@@H]2C\C(C[C@H]12)=C\CCCC(O)=O
|
|
MolPort-028-610-215 |
0.71 |
CC(CC(O)C(O)C(C)(C)O)C1=C2CCC3C4(C)CCC(=O)C(C)(C)C4CCC3(C)C2(C)CC1O
|
|
MolPort-002-053-425 |
0.71 |
NC(CC(O)=O)C1CCC=CC1
|
|
MolPort-003-940-710 |
0.71 |
CCCCC[C@H](O)\C=C\[C@H]1[C@H](O)C[C@@H]2C\C(C[C@H]12)=C/CCCC(O)=O
|
|
MolPort-035-705-871 |
0.71 |
C[C@]1(CO)CCC[C@@]2(C)[C@@H]3CC[C@@H]4C[C@@]3(CC[C@H]12)C=C4C(O)=O
|
|
MolPort-046-691-387 |
0.71 |
C[C@@H]1CC[C@H]([C@H]2C=C(C)CC[C@@H]12)C(=C)CO
|
|
MolPort-038-386-697 |
0.71 |
CC1CCC(O)C2(C)CCC(C=C12)C(C)(C)O
|
|
MolPort-027-835-542 |
0.71 |
C[C@]12CCC[C@](C)([C@@H]1CC[C@]13CC(=C)[C@@](O)(C1)CC[C@H]23)C(O)=O
|
|
MolPort-044-755-206 |
0.71 |
C[C@]12CC[C@H]3[C@@H](C=C[C@@H]4CC(=O)CC[C@]34C)[C@@H]1CCC2=O
|
|
MolPort-039-338-735 |
0.71 |
C[C@H]([C@H](O)CC=C(C)C)[C@H]1CC[C@@]2(C)C3=C(CC[C@]12C)[C@@]1(C)CC[C@H](O)C(C)(C)C1CC3
|
|
MolPort-019-937-461 |
0.71 |
CC1(C)[C@H](O)[C@H](O)C[C@]2(C)[C@H]3CCC4[C@@](C)(CCC5[C@@](C)(CO)[C@H](O)CC[C@]45C)CC3=CC[C@@H]12
|
|
MolPort-039-338-304 |
0.71 |
C[C@@]12CCC[C@](C)([C@H]1CC[C@@]13C[C@H](CC[C@@H]21)C(=C)[C@@H]3O)C(O)=O
|
|
MolPort-020-005-960 |
0.71 |
C[C@@]12CCC[C@](C)([C@H]1CC[C@@]13CC(=C)[C@@](O)(C1)CC[C@@H]23)C(O)=O
|
|
MolPort-021-804-706 |
0.71 |
CC1(O)C(O)CCC2(C)CCC(CC12)C(=C)C(O)=O
|
|
MolPort-039-052-525 |
0.71 |
CC(C)C1=CC[C@@]2(C)[C@H](O)CC[C@](C)(O)[C@@H]2C1
|
|
MolPort-046-691-388 |
0.71 |
C[C@@H]1CC[C@H]([C@H]2C=C(C)CC[C@@H]12)C(=C)C=O
|
|
MolPort-029-943-150 |
0.71 |
CC1=CCC2C(C)(CO)CCCC2(C)C1CO
|
|
MolPort-035-706-308 |
0.71 |
CC1(C)CC[C@]2(C)CC[C@]3(C)[C@H]4CC=C5[C@@H](CC[C@H](O)C5(C)C)[C@]4(C)CC[C@@]3(C)[C@@H]2C1
|
|
MolPort-046-153-069 |
0.71 |
C[C@]12CCC[C@](C)([C@H]1CC[C@@]13CC(=C)[C@@](O)(C1)CC[C@@H]23)C(O)=O
|
|
MolPort-039-052-637 |
0.71 |
C[C@@]12CCC[C@](C)([C@H]1CC[C@@]13C[C@H](CC[C@@H]21)C(=C)[C@H]3O)C(O)=O
|
|
MolPort-035-706-319 |
0.71 |
CC1(C)CC[C@]2(C)CC[C@]3(C)[C@H]4CC=C5[C@@H](CCC(=O)C5(C)C)[C@]4(C)CC[C@@]3(C)[C@@H]2C1
|
|
MolPort-046-594-199 |
0.71 |
CC12CCCC(C)(C1CCC13CC(=C)C(O)(C1)CCC23)C(O)=O
|
|
MolPort-035-706-402 |
0.71 |
CC1(C)[C@H](O)[C@H](O)C[C@]2(C)[C@H]3CC[C@H]4[C@@](C)(CC[C@H]5[C@@](C)(CO)[C@H](O)CC[C@]45C)CC3=CC[C@@H]12
|
|
MCULE-1403801057 |
0.71 |
C(CCCCCC(=O)O)CCCCCCC=C
|
|
MCULE-9571611941 |
0.71 |
OC(C1(CC=CC1)CC1CC2C(C2)C1)=O
|
|
MCULE-2837812117 |
0.71 |
C=C(C)CCCCC(=O)O
|
|
MCULE-7880412465 |
0.71 |
C(O)(C(C1CCCC=1)CCC)=O
|
|
MCULE-8386752633 |
0.71 |
O=C1CCC2(C)C3C(C4CCC(C4(C)C(C=3)=O)C(OC)=O)CCC2([H])C1
|
|
MCULE-7062667000 |
0.71 |
[C@@H]1(CC=CC[C@H]1C(O)=O)C(O)=O
|
|
MCULE-7974840074 |
0.71 |
C(CCCCCCCCC(CCCCCC(O)=O)=O)=C
|
|
MCULE-6091105789 |
0.71 |
C=C(CCCCCC(=O)O)C
|
|
MCULE-8394821836 |
0.71 |
C12(C)C(=O)C=C(O)C(CC1)C2(C)C
|
|
MCULE-7543238538 |
0.71 |
C(O)(=O)CCC1C(=O)CCCC=1
|
|
MCULE-7444972832 |
0.71 |
C(O)(=O)CCC/C=C1/C[C@@]2([H])[C@@]([H])(C/1)C[C@@H](O)[C@@H]2/C=C/[C@@H](O)CCCCC
|
|
MCULE-2457325018 |
0.71 |
C1CC(CCCCC(OCC)=O)CCC=1C
|
|
MCULE-3560182453 |
0.71 |
C1C[C@]2([C@]3([H])CC[C@H]4C(C(=O)O)=C[C@@]3(C4)CC[C@]2([H])[C@@](C)(CO)C1)C
|
|
MCULE-8327830017 |
0.71 |
C1CC2(C)C3CCC4=C(C(CC(O)C(O)C(O)(C)C)C)C(O)CC4(C)C3(C)CCC2C(C)(C)C1=O
|
|
MCULE-4929710192 |
0.71 |
C[C@@]1(CCC[C@@]2(C)[C@@]3([H])[C@]4(C[C@](CC3)([H])C(C(=O)O)=C4)CC[C@]12[H])CO
|
|
MCULE-4298708464 |
0.71 |
C(C(N)C1CCC=CC1)C(O)=O
|
|
MCULE-4900399116 |
0.71 |
C1CC2C(=O)C3CC=CCC3C(=O)C2CC=1
|
|
MCULE-3735012527 |
0.71 |
C[C@@]1([C@@]2([H])[C@]([C@]3(CC[C@@]4(C[C@]3(CC2)CC4=C)O)[H])(C)CCC1)C(=O)O
|
|
MCULE-9706743745 |
0.71 |
C1C[C@]2(C)[C@]3([H])CC[C@@]4(O)C(=C)C[C@@]3(C4)CC[C@]2([H])[C@](C)(C(=O)O)C1
|
|
MCULE-7760721294 |
0.71 |
C1CC2(CCCCC2(CO)C(C)C=1)CO
|
|
MCULE-2458365976 |
0.71 |
C1CC2(C)CCC(C(=C)C(=O)O)CC2C(O)(C)C1O
|
|
MCULE-6626480267 |
0.71 |
C1CC2C(O)C3CC=CCC3C(O)C2CC=1
|
|
MCULE-4051240768 |
0.71 |
C12C3CCC(=O)C3(C)CCC=1C1C(C)(CC2)CC(=O)CC1
|
|
MCULE-7230877379 |
0.71 |
O=C1CCC(C2CC=CCC21)=O
|
|
MCULE-6601187734 |
0.71 |
C1CC23CCC(=O)C2(CCCC3)CC=1
|
|
MCULE-4154375600 |
0.71 |
C12(C(CC=CC1)(CO)CCCC2)CO
|
|
MCULE-1233983645 |
0.71 |
CC12C3CCC4(O)C(CC3(C4)CCC1C(C(O)=O)(C)CCC2)=C
|
|
MCULE-4453341269 |
0.71 |
O=C1C2CC(C)=C(C)CC2C(C2CC(C)=C(C)CC21)=O
|
|
MCULE-9111462538 |
0.71 |
O=C1C(C)(C)C2=CCCCC2(C)CC1
|
|
MCULE-5421418726 |
0.71 |
C1CC2CCCC=C2C(C)(C)C1=O
|
|
MCULE-8251326522 |
0.71 |
C=C1C[C@@]23[C@](CC[C@@]1(C2)O)([H])[C@@]1(C)[C@]([C@@](CCC1)(C(=O)O)C)([H])CC3
|
|
MCULE-8722569228 |
0.71 |
C1CC2(C)C(CO)C(C)=CCC2C(CO)(C)C1
|
|
MCULE-4778747911 |
0.71 |
C1C(O)C2(C)CCC(C(O)(C)C)C=C2C(C)C1
|
|
MCULE-7364976100 |
0.71 |
C1[C@@H](O)[C@]2(C)CC=C(C(C)C)C[C@@]2([H])[C@@](C)(O)C1
|
|
MCULE-7446284675 |
0.71 |
C1=CC2CCC1C(CO)C2CO
|
|
MCULE-5486393555 |
0.71 |
C(OC)(C1(O)CCC2C1(C)CCC1C2CC=C2CC(O)CCC21C)=O
|
|
MCULE-9646499830 |
0.71 |
OC(C1(CC=CCC1)CC1C(F)(F)C1)=O
|
|
MCULE-6072665694 |
0.71 |
C12=CC(=O)[C@]3([C@](C)(CC[C@@H](O)C3)C1CC[C@]1(C)C(CC[C@@]21O)[C@@](C)(O)[C@H](O)CCC(C)(C)O)[H]
|
|
MCULE-7990472329 |
0.71 |
C1(CC2(CC1([H])C=C2)[H])C(N)C(O)=O
|
|
MCULE-9679346580 |
0.71 |
C(O)(C1C2C(=C(C)C)C(C=C2)C1C(O)=O)=O
|
|
MCULE-8030446235 |
0.71 |
[C@@H]1(O)C[C@]2(C)CC[C@@H](C(C(=O)O)=C)C=C2[C@@H](C)[C@H]1O
|
|
MCULE-5049706558 |
0.71 |
C1(CC(O)=O)(C(O)CCC(=O)C1)C/C=C(\C)/CC(/C=C(\C)/C)=O
|
|
MCULE-5791637196 |
0.71 |
C1CCC23CC12C(O)C=CC3=O
|
|
MCULE-2449230661 |
0.71 |
C1(CC2CC1C=C2)C(OC)=O
|
|
MCULE-8982382729 |
0.71 |
C12[C@H](C)C[C@]3([C@@]([H])(CC[C@]4([H])C[C@@H](CC[C@]34C)OC(C)=O)[C@]1([H])CCC=2C(C)CCC(OC)=O)[H]
|
|
MCULE-2434156493 |
0.71 |
OC(C1(CC=CCC1)CC1(C#N)CC1)=O
|
|
MCULE-6077958460 |
0.71 |
C(OC)(CC1(O)CCC2C1(C)CCC1C2CC=C2CC(O)CCC21C)=O
|
|
MCULE-6259050360 |
0.71 |
[C@@]12(C)CCC(C(C)CCC(O)=O)[C@@]1(C)CCC1[C@@]3(C(C(C)(C)C(CC3)OC(C)=O)CCC2=1)C
|
|
MCULE-1916767135 |
0.71 |
O=C1CCC2(CO)C3CCC4(C)C(CCC4(O)C3CCC2=C1)C(CO)=O
|
|
MCULE-6540776662 |
0.71 |
CC1(CCC1)CC1(C(O)=O)CC=CC1
|
|
MCULE-2795374734 |
0.71 |
OC(C1(C2CCCC2)CC=CC1)=O
|
|
MCULE-4248274366 |
0.71 |
OC(C1(CC=CC1)CC1CCCC1)=O
|
|
MCULE-3699449483 |
0.71 |
OC(C1(C2CCC2)CC=CC1)=O
|
|
MCULE-6215916748 |
0.71 |
OC(C1(CC=CC1)CC1CC1)=O
|
|
MCULE-6699414453 |
0.71 |
CC1(CCCC1)CC1(C(O)=O)CC=CC1
|
|
MCULE-5820761773 |
0.71 |
OC(C1(C2CCCCCC2)CC=CC1)=O
|
|
MCULE-6852628228 |
0.71 |
OC(C1(CC=CC1)CC1CCC1)=O
|
|
MCULE-6276076551 |
0.71 |
C(OC)(C1CCC2C1(C)CCC1C=2CCC2(O)CC(O)CCC21CO)=O
|
|
MCULE-3892173219 |
0.71 |
C(CCCCCCCC=C)(O)=O
|
|
MCULE-4078078854 |
0.71 |
CC(C(C)=O)CC1CC=CCC1
|
|
MCULE-1091603091 |
0.71 |
C1=C(C)CC[C@@](C)(CCC(C)O)C1C
|
|
MCULE-5277132939 |
0.71 |
C1[C@@H](C(O)=O)[C@H](C(O)=O)CC=C1
|
|
MCULE-2215895979 |
0.71 |
C1=C(C)CCC(C)(CCC(CC)O)C1C
|
|
MCULE-8227436556 |
0.71 |
C1(=O)CCCC=CCCCCCCCCCC1
|
|
MCULE-6863504457 |
0.71 |
O=C(CCCCC(O)=O)CCCCCCCCC=C
|
|
MCULE-7928135942 |
0.71 |
C(CCCCCCCCC=C)(O)=O
|
|
MCULE-4736378843 |
0.71 |
CC(C=O)(CC1CC=CCC1)C
|
|
MCULE-8120111177 |
0.71 |
C1CC(C)(C(=O)O)C([H])(C(=O)O)CC=1
|
|
MCULE-8208403883 |
0.71 |
C1(CC=CCC1C(O)=O)C(O)=O
|
|
MCULE-9714012387 |
0.71 |
C(CCCCCCC(=O)O)C(=O)CCCCCCCCC=C
|
|
MCULE-6571932731 |
0.71 |
C=CCCCCCC(=O)O
|
|
MolPort-006-112-811 |
0.71 |
C[C@]1(O)CC[C@H]2[C@@H]3CCC4=CC(=O)CC[C@]4(C)C3=CC[C@]12C
|
|
MolPort-001-762-335 |
0.71 |
COC(=O)C1CC2CC1C=C2
|
|
MolPort-002-524-727 |
0.71 |
CC(C)(O)CC[C@@H](O)[C@](C)(O)C1CC[C@@]2(O)C3=CC(=O)[C@@H]4C[C@H](O)CC[C@]4(C)C3CC[C@]12C
|
|
MolPort-008-346-698 |
0.71 |
CC(CCC(O)=O)C1CC[C@@]2(C)C3=C(CC[C@]12C)[C@@]1(C)CCC(OC(C)=O)C(C)(C)C1CC3
|
|
MolPort-028-610-078 |
0.71 |
CC(=C)CCC(=O)[C@](C)(O)C1[C@H](O)C[C@@]2(C)C3CC=C4C(C[C@H](O)[C@@H](O)C4(C)C)[C@]3(C)C(=O)C[C@]12C
|
|
MolPort-003-698-563 |
0.71 |
COC(=O)C1CC2CC1C=C2
|
|
MolPort-004-769-059 |
0.71 |
OC(=O)C1CC2C=CC1C2=O
|
|
MolPort-002-534-834 |
0.71 |
CC(C)(O)CC[C@@H](O)[C@](C)(O)C1CC[C@@]2(O)C3=CC(=O)[C@@H]4C[C@@H](O)CC[C@]4(C)C3CC[C@]12C
|
|
MolPort-000-000-426 |
0.71 |
NC(C1CC2CC1C=C2)C(O)=O
|
|
MolPort-046-765-406 |
0.71 |
C[C@]12C[C@H](O)[C@H]3[C@@H](CCC4=CC(=O)CC[C@]34C)[C@@H]1CC[C@]2(O)C(O)C(O)=O
|
|
MolPort-046-790-498 |
0.71 |
C[C@H](CC(O)C(O)C(C)=C)[C@H]1CC[C@@]2(C)[C@@H]3[C@@H](O)C=C4[C@@H](CC[C@H](O)C4(C)C)[C@@]3(CC[C@]12C)C=O
|
|
MolPort-042-648-454 |
0.71 |
N[C@@H](C1CC2CC1C=C2)C(O)=O
|
|
MolPort-046-765-744 |
0.71 |
C[C@]12C[C@H](O)[C@H]3[C@@H](CCC4=CC(=O)CC[C@]34C)[C@@H]1C[C@@H](O)[C@@H]2C(O)C(O)=O
|
|
MolPort-039-052-469 |
0.71 |
C[C@H]1[C@@H](O)[C@H](O)C[C@]2(C)CC[C@H](C=C12)C(=C)C(O)=O
|
|
MolPort-046-702-598 |
0.71 |
OCCN(CCO)CCO.OCCN(CCO)CCO.CCCCCCC1C=CC(CCCCCCCC(O)=O)CC1C(O)=O
|
|
MolPort-006-169-924 |
0.71 |
CCCCC\C=C/C=C/CCCCCCCCC(O)=O
|
|
MolPort-046-689-149 |
0.71 |
CCCCC\C=C\C=C\CCCCCCCCC(O)=O
|
|
MolPort-009-018-846 |
0.71 |
CCCCC\C=C/C=C\CCCCCCCCC(O)=O
|
|
MolPort-046-762-101 |
0.71 |
[Fe++].C1CC=C[CH-]1.OC(=O)CC1C[CH-]C=C1
|
|
MolPort-009-018-862 |
0.71 |
CCCCCC\C=C\C=C/CCCCCCCC(O)=O
|
|
MolPort-003-959-458 |
0.70 |
CCCCCC[C@@H](O)C\C=C/CCCCCCCC(=O)OC
|
|
MolPort-042-675-234 |
0.70 |
C[C@@H](CC\C=C(\C)C(O)=O)[C@@H]1CC[C@]2(C)C3=CCC4C(C)(C)C(=O)CC[C@]4(C)C3CC[C@@]12C
|
|
MolPort-046-677-790 |
0.70 |
OC(=O)C1=CC2CCCCCCC12
|
|
MolPort-039-052-451 |
0.70 |
C[C@H](CC\C=C(/C)C(O)=O)[C@H]1CC[C@@]2(C)C3CCC4C(C)(C)C(=O)CC[C@]4(C)C3=CC[C@]12C
|
|
MolPort-039-338-097 |
0.70 |
C[C@H](CC\C=C(/C)C(O)=O)[C@H]1CC[C@@]2(C)C3CCC4C(C)(C)[C@@H](O)CC[C@]4(C)C3=CC[C@]12C
|
|
MolPort-039-052-641 |
0.70 |
C[C@@H](CC\C=C(\C)C(O)=O)[C@@H]1CC[C@]2(C)C3=CC[C@H]4C(C)(C)[C@@H](O)CC[C@]4(C)[C@H]3CC[C@@]12C
|
|
MolPort-028-952-171 |
0.70 |
OC(=O)C1=CCCCCC1
|
|
MolPort-002-515-602 |
0.70 |
CCCCCCCCCCCCCC(O)=C1C(=O)CC(C)(C)CC1=O
|
|
MolPort-044-754-142 |
0.70 |
C[C@H](CC\C=C(/C)C(O)=O)[C@H]1CC[C@@]2(C)C3=C(CC[C@]12C)[C@@]1(C)CCC(=O)C(C)(C)C1CC3
|
|
MolPort-019-937-479 |
0.70 |
CC1(C)C[C@@H](O)[C@]2(C)CC[C@]3(C)C(=CCC4[C@@]5(C)CC[C@H](O)C(C)(C)C5CC[C@@]34C)[C@@H]2C1
|
|
MolPort-042-620-773 |
0.70 |
CC(=O)C1CCC(C)=C(C)C1
|
|
MolPort-006-123-991 |
0.70 |
CC(C)=CCC[C@](C)(O)[C@H]1CCC(C)=CC1
|
|
MolPort-002-559-654 |
0.70 |
CC1CC(C)=CC(C)[C@@H]1C=O
|
|
MolPort-044-657-110 |
0.70 |
OC(=O)CC1(CCCCC1)C=C
|
|
MolPort-001-740-928 |
0.70 |
C[C@@]12CCC[C@](C)(C1CCC13CC(CCC21)C(=C)C3)C(O)=O
|
|
MolPort-046-764-482 |
0.70 |
C[C@]12CC[C@H]3[C@@H](CC[C@H]4C[C@H](O)CC(=C)[C@]34C)[C@@H]1CCC2=O
|
|
MolPort-046-764-422 |
0.70 |
[2H]C([2H])([2H])C(O)(CCC=C(C)C)[C@H]1CCC(C)=CC1.[2H]C([2H])([2H])C(O)(CCC=C(C)C)[C@@H]1CCC(C)=CC1
|
|
MolPort-002-506-991 |
0.70 |
CC1CC2=C(CC1(C)C(C)=O)C(C)(C)CCC2
|
|
MolPort-002-042-108 |
0.70 |
CC1=CCC(CC1)C(C)(C)O
|
|
MolPort-001-956-819 |
0.70 |
CC1C=C(C)CCC1C=O
|
|
MolPort-001-895-260 |
0.70 |
CC1CC2=C(CC1CO)C(C)(C)CCC2
|
|
MolPort-002-534-147 |
0.70 |
CC(C)=CCCC(C)(O)C1CCC(C)=CC1
|
|
MolPort-003-925-627 |
0.70 |
CC1(C)CC[C@]2(CO)CC[C@]3(C)C(=CC[C@@H]4[C@@]5(C)CC[C@H](O)C(C)(C)[C@@H]5CC[C@@]34C)[C@@H]2C1
|
|
MolPort-003-895-994 |
0.70 |
CC(=O)C1CCC(C)=CC1
|
|
MolPort-039-242-524 |
0.70 |
CC1=C(C)CC(CC1)C(C)(C)O
|
|
MolPort-022-371-002 |
0.70 |
OC(=O)C1(CC=C)CCCCC1
|
|
MolPort-039-052-710 |
0.70 |
C[C@@]12CCC[C@](C)([C@H]1CC[C@@]13C[C@H](CC[C@@H]21)C(=C)C3)C(O)=O
|
|
MolPort-000-729-513 |
0.70 |
CC1CC2=C(CC1C=O)C(C)(C)CCC2
|
|
MolPort-044-723-330 |
0.70 |
C[C@@]12CCC[C@](C)([C@H]1CC[C@@]13C[C@@H](CC[C@@H]21)C(=C)C3)C(O)=O
|
|
MolPort-000-745-819 |
0.70 |
CC1CC(C)=CC(C)C1C=O
|
|
MolPort-003-959-866 |
0.70 |
C[C@@H]1CC[C@]2(CO)CC[C@]3(C)C(=CC[C@@H]4[C@@]5(C)CC[C@H](O)C(C)(C)[C@@H]5CC[C@@]34C)[C@@H]2[C@H]1C
|
|
MolPort-003-939-209 |
0.70 |
CC1=CC[C@@H](CC1)C(C)(C)O
|
|
MolPort-003-932-718 |
0.70 |
CC1=CC[C@H](CC1)C(C)(C)O
|
|
MolPort-046-774-180 |
0.70 |
OC(=O)C1(CCCCC1)C=C
|
|
MolPort-003-986-853 |
0.70 |
C[C@]12CC[C@H]3[C@@H](CCC4=CCCC[C@H]34)[C@@H]1CC[C@@]2(O)CC=C
|
|
MolPort-020-015-946 |
0.70 |
CC(C)=CCC[C@@](C)(O)[C@@H]1CCC(C)=CC1
|
|
MolPort-038-386-720 |
0.70 |
CC1(C)CCCC2(C)C1CCC1(C)C(CC(O)=O)C(=C)CCC21
|
|
MolPort-027-637-273 |
0.70 |
CC1=C2C[C@@H](CC[C@]2(C)CCC1)C(C)(C)O
|
|
MolPort-002-521-717 |
0.70 |
C[C@]12CC[C@H]3[C@@H](CCC4=CC(=O)CC[C@]34C)[C@@H]1CC[C@]2(O)C#N
|
|
MolPort-002-507-150 |
0.70 |
C[C@]12CC[C@H]3[C@@H](CCC4=CC(=O)CC[C@]34C)[C@@H]1CC[C@@]2(O)C#C
|
|
MolPort-007-980-824 |
0.70 |
CCC12CCC3C(CCC4=CC(=O)CCC34)C1C[C@@H](C#C)C2O
|
|
MolPort-002-911-093 |
0.70 |
CC12CCC3C(CCC4=CC(=O)CCC34C)C1CC[C@@]2(O)C#C
|
|
MolPort-046-690-660 |
0.70 |
C[C@]12CC[C@H]3[C@@H](CCC4=CC(=O)CC[C@H]34)[C@@H]1CC[C@]2(O)C#C
|
|
MolPort-002-354-182 |
0.70 |
CC12CCC3C(CCC4=CC(=O)CCC34C)C1CCC2(O)CC#N
|
|
MolPort-003-666-244 |
0.70 |
CC[C@]12CCC3C(CCC4=CC(=O)CC[C@H]34)C1CC[C@@]2(O)C#C
|
|
MolPort-046-687-422 |
0.70 |
C[C@@H](CC(=O)C=C(C)C)[C@H]1C[C@H](O)[C@@](C)(O)C=C1
|
|
MolPort-002-507-131 |
0.70 |
C[C@]12CC[C@H]3[C@@H](CCC4=CC(=O)CC[C@H]34)[C@@H]1CC[C@@]2(O)C#C
|
|
MolPort-046-418-348 |
0.70 |
COC(=O)[C@]12CCC(C)(C)C[C@H]1C1=CC[C@@H]3[C@@]4(C)CCC([C@@H]4CC[C@@]3(C)[C@]1(C)CC2)=C(C)C
|
|
MolPort-003-861-444 |
0.70 |
CC12CCC3C(CCC4=CC(=O)CCC34)C1CCC2(O)C#C
|
|
MolPort-046-418-349 |
0.70 |
COC(=O)[C@]12CCC(C)(C)C[C@H]1C1=CC[C@@H]3[C@@]4(C)CCC(=O)[C@@H]4CC[C@@]3(C)[C@]1(C)CC2
|
|
MolPort-005-933-833 |
0.70 |
CCC12CCC3C(CCC4=CC(=O)CCC34)C1CCC2(O)C#C
|
|
MolPort-027-641-194 |
0.70 |
CC[C@]12CC[C@H]3[C@@H](CCC4=CC(=O)CCC34)[C@@H]1CC[C@@]2(O)C#C
|
|
MolPort-046-426-723 |
0.70 |
[2H]C1=C2C([2H])([2H])C[C@H]3[C@@H]4CC[C@@](O)(C#C)[C@@]4(CC)CC[C@@H]3[C@@]2([2H])CC([2H])([2H])C1=O
|
|
MolPort-003-849-619 |
0.70 |
[2H]C1=C2C([2H])([2H])CC3C4CC[C@@](O)(C#C)C4(C)CCC3C2([2H])CC([2H])([2H])C1=O
|
|
MolPort-006-111-863 |
0.70 |
C[C@]12CCC(=O)C=C1CC[C@H]1[C@@H]3CC[C@H](C(=O)CO)[C@@]3(CO)C[C@H](O)[C@H]21
|
|
MolPort-002-510-453 |
0.70 |
CC[C@]12CC[C@H]3[C@@H](CCC4=CC(=O)CC[C@H]34)[C@@H]1CC[C@@]2(O)C#C
|
|
MolPort-002-512-104 |
0.70 |
C[C@]12CCC3C(CCC4=CC(=O)CC[C@]34C)C1CC[C@@]2(O)C#N
|
|
MolPort-046-589-843 |
0.70 |
COCC(=O)[C]1CC[C@@H]2[C]1C[CH][C@H]1[C@H]2CCC2=CC(=O)CC[C@]12C
|
|
MolPort-002-728-977 |
0.70 |
CC12CCC3C(CCC4=CC(=O)CCC34)C1CCC2(O)C#C
|
|
MolPort-002-509-542 |
0.70 |
C[C@]12CCC3C(CCC4=CC(=O)CC[C@H]34)C1CC[C@@]2(O)C#C
|
|
MolPort-046-765-414 |
0.70 |
CC[C@]12CC[C@@H]3[C@@H](CCC4=CC(=O)CC[C@H]34)[C@H]1CC[C@]2(O)C#C
|
|
MolPort-035-668-919 |
0.70 |
CC1=C2CCC3C4C[C@@H](C#C)C(O)C4(C)CCC3C2CCC1=O
|
|
MolPort-039-338-301 |
0.70 |
CC1C(O)C(=O)C=C(C)C11CCC(C1)C(C)(O)CO
|
|
MolPort-000-832-099 |
0.70 |
C[C@]12CCC3C(CCC4=CC(=O)CC[C@]34C)C1CC[C@]2(O)C#N
|
|
MolPort-000-829-116 |
0.70 |
C[C@]12CCC3C(CCC4=CC(=O)CC[C@]34C)C1CC[C@@]2(O)C#C
|
|
MolPort-001-785-935 |
0.70 |
CC12CCC3C(CCC4=CC(=O)CCC34C)C1CCC2(O)C#C
|
|
MolPort-000-745-547 |
0.70 |
CC12CCC3C(CCC4=CC(=O)CC[C@H]34)C1CC[C@@]2(O)C#C
|
|
MolPort-046-765-484 |
0.70 |
C[C@]12CC[C@H]3[C@@H](CCC4=CC(=O)CC[C@]34C)[C@@H]1CC[C@@]2(O)[13C]#[13CH]
|
|
MolPort-046-765-464 |
0.70 |
C[C@@H]1CC2=CC(=O)CC[C@@H]2[C@H]2CC[C@@]3(C)[C@@H](CC[C@@]3(O)C#C)C12
|
|
MolPort-000-700-357 |
0.70 |
CC12CC[C@H]3[C@@H](CCC4=CC(=O)CCC34C)[C@@H]1CC[C@@]2(O)C#C
|
|
MolPort-035-706-434 |
0.70 |
C[C@@H](CC\C=C(\C)C(O)=O)[C@@H]1CC[C@]2(C)C3=CC[C@@H](C(C)=C)[C@](C)(CCC(O)=O)[C@H]3CC[C@@]12C
|
|
MolPort-046-765-289 |
0.70 |
[2H]C#C[C@]1(O)CC[C@H]2[C@@H]3CC([2H])([2H])C4=C([2H])C(=O)C([2H])([2H])C[C@]4([2H])[C@H]3CC[C@]12CC
|
|
MolPort-046-765-288 |
0.70 |
[2H]C1=C2C([2H])([2H])C[C@H]3[C@@H]4CC[C@@](O)(C#C)[C@]4(CC)CC[C@@H]3[C@@]2([2H])CC([2H])([2H])C1=O
|
|
MolPort-001-512-549 |
0.70 |
CC12CCC3C(CCC4=CC(=O)CCC34C)C1CCC2(O)C#N
|
|
MolPort-044-727-657 |
0.70 |
[Na+].CC\C=C/C\C=C/C\C=C/C\C=C/C\C=C/CCCC([O-])=O
|
|
MolPort-021-804-808 |
0.70 |
CC1(CC(O)C2(C1)CCC1C(C)(CCCC1(C)C2=O)C(O)=O)C=C
|
|
MolPort-035-705-831 |
0.70 |
CC(C)C1=CC2=CC[C@@H]3[C@](C)(CCC[C@@]3(C)C(O)=O)[C@H]2C[C@@H]1O
|
|
MCULE-6477437107 |
0.70 |
C1(CCCC(=O)C=1)C(O)=O
|
|
MCULE-5230788025 |
0.70 |
C1(=C(/CCCCCCCCCCCCC)\O)\C(=O)CC(CC\1=O)(C)C
|
|
MCULE-5183068201 |
0.70 |
C(CCCCCCCC=CCC(CCCCCC)O)(OC)=O
|
|
MCULE-5897136444 |
0.70 |
[C@@H](O)(CCCCCC)CC=CCCCCCCCC(=O)OC
|
|
MCULE-4243027733 |
0.70 |
C(O)(C1C(C)(C)C(C=CC(O)=O)(C)CC1)=O
|
|
MCULE-8116500557 |
0.70 |
C1(C=O)C(=O)CC(CC=1O)(C)C
|
|
MCULE-2137893098 |
0.70 |
C12C(C)(C)CCCC=1CC(C)C(C)(C(C)=O)C2
|
|
MCULE-1620592725 |
0.70 |
C12=CCC3(C(C)(CCC4([H])C(C(O)CCC34C)(C)C)C1(C)CCC1(CO)CCC(C)C(C)C21[H])[H]
|
|
MCULE-9174314602 |
0.70 |
C1C[C@H](CCC=1C)[C@](C)(CC/C=C(\C)/C)O
|
|
MCULE-6184897823 |
0.70 |
C(O)(C)(C)[C@@H]1CC=C(C)CC1
|
|
MCULE-8948864854 |
0.70 |
C(O)(C)(C)[C@H]1CC=C(C)CC1
|
|
MCULE-5456178986 |
0.70 |
OC(=O)[C@]1([C@]2(CC[C@]34C[C@H](C(=C)C3)CC[C@@]4([H])[C@]2(C)CCC1)[H])C
|
|
MCULE-6240066964 |
0.70 |
C1C(C)=CC[C@H](C(O)(C)C)C1
|
|
MCULE-9666470335 |
0.70 |
O[C@@]1(CC=C)CC[C@]2([H])[C@]1(C)CC[C@]1([H])[C@@]3([H])CCCC=C3CC[C@@]21[H]
|
|
MCULE-4834546197 |
0.70 |
C1=C(C)CCC(C=O)C1C
|
|
MCULE-3149377803 |
0.70 |
C1CC(CCC=1C)C(C)=O
|
|
MCULE-7846055076 |
0.70 |
C1C[C@@]([H])(CCC=1C)[C@@](C)(CC/C=C(/C)\C)O
|
|
MCULE-3804311142 |
0.70 |
C1C2CC(CC(=O)C)C(C2)C=1
|
|
MCULE-5010058438 |
0.70 |
[H]C12CCCC=C1CCC1C3CCC(CC=C)(O)C3(C)CCC21
|
|
MCULE-6340408888 |
0.70 |
C1CC2(C)C3CCC(=C)C(CC(=O)O)C3(C)CCC2C(C)(C)C1
|
|
MCULE-3918504016 |
0.70 |
[C@@]12([H])CC[C@@](O)(CC=C)[C@@]1(C)CC[C@]1([H])[C@@]3([H])CCCC=C3CC[C@@]21[H]
|
|
MCULE-3433336466 |
0.70 |
C1=C(C)CC(C(C=O)C1C)C
|
|
MCULE-4640003531 |
0.70 |
C1C[C@@]2(C)C3C4(CCC2[C@@](C(O)=O)(C)C1)CC(=C)C(CC3)C4
|
|
MCULE-6735391183 |
0.70 |
C12C(C)(C)CCCC=1CC(C)C(C=O)C2
|
|
MCULE-8414811975 |
0.70 |
CC(C)([C@H]1CCC(C)=CC1)O
|
|
MCULE-9761993676 |
0.70 |
C1=C(C)CC([C@@H](C=O)C1C)C
|
|
MCULE-7682763192 |
0.70 |
[C@@]12(C)CC[C@@]3(CO)CC[C@@H](C)[C@H](C)[C@@]3([H])C1=CC[C@]1([H])[C@@]3(C)CC[C@H](O)C(C)(C)[C@]3([H])CC[C@]12C
|
|
MCULE-3300513366 |
0.70 |
C1(=C)[C@@H]2C[C@@]3(CC[C@H]4[C@@](C)(CCC[C@@]4(C)C(O)=O)[C@@H]3CC2)C1
|
|
MCULE-3174021569 |
0.70 |
OC(=O)[C@]1([C@]2(CC[C@]34C[C@H](C(=C)C3)CC[C@@]4([H])[C@]2(C)CCC1)[H])C
|
|
MCULE-9083020972 |
0.70 |
C1C[C@@]2(C)CC[C@@H](C(O)(C)C)CC2=C(C)C1
|
|
MCULE-3206249578 |
0.70 |
C1CC(CCC=1C)C(C)(CC/C=C(\C)/C)O
|
|
MCULE-9798755896 |
0.70 |
C1CC(CCC=1C)C(C)(C)O
|
|
MCULE-1505073195 |
0.70 |
C(C(=O)O)C[C@]1(C)[C@@]2([H])CC[C@]3([C@]([H])([C@H](CC/C=C(\C(O)=O)/C)C)CC[C@]3(C)C2=CC[C@@]1([H])C(C)=C)C
|
|
MCULE-9068467553 |
0.70 |
[C@]12(C)CCC(C=C1CCC1C2CC[C@]2(C1CC[C@]2(O)C#N)C)=O
|
|
MCULE-9156628994 |
0.70 |
[C@]12(C)CC[C@]3([C@@]([H])(CCC4=CC(=O)CC[C@@]43[H])[C@]1([H])CC[C@@]2(O)C#C)[H]
|
|
MCULE-9892383905 |
0.70 |
[C@]12(CC)CC[C@]3([C@@]([H])(CCC4=CC(=O)CC[C@@]43[H])[C@]1([H])CC[C@]2(O)C#C)[H]
|
|
MCULE-3410664208 |
0.70 |
[C@]12(C)CC[C@]3([C@@]([H])(CCC4=CC(=O)CC[C@@]43[H])[C@]1([H])CC[C@@]2(O)C#C)[H]
|
|
MCULE-6251052191 |
0.70 |
C12(C)CCC3C(CCC4=C(C(=O)CCC43)C)C1CC(C#C)C2O
|
|
MCULE-9075563464 |
0.70 |
O=C1C2C(CC(O)=O)CC(C=2C(C)(C)CC1)=O
|
|
MCULE-4509039878 |
0.70 |
CC12C(CC#N)(O)CCC1C1CCC3C(C)(C1CC2)CCC(=O)C=3
|
|
MCULE-2444850987 |
0.70 |
C12(C)CCC(C=C1CCC1C2CCC2(C1CCC2(O)C#N)C)=O
|
|
MCULE-2776644728 |
0.70 |
C12(CC)CCC3C(CCC4=CC(=O)CCC43)C1C[C@@H](C#C)C2O
|
|
MCULE-6301437684 |
0.70 |
O=C1CCC2(C3CCC4(CC)C(O)(CCC4C3CCC2=C1)C#C)[H]
|
|
MCULE-1283162506 |
0.70 |
CC[C@@]12[C@@](C#C)(O)CC[C@H]1[C@@H]1CCC3[C@@H]([C@H]1CC2)CCC(=O)C=3
|
|
MCULE-5475119384 |
0.70 |
O=C1C=C2[C@]([C@@]3([C@](CC2)([H])[C@@]2([H])[C@]([C@](CC2)(O)C#C)(C)CC3)[H])(C)CC1
|
|
MCULE-5532388657 |
0.70 |
CC[C@@]12[C@@](C#C)(O)CC[C@H]1[C@@H]1CCC3[C@@H]([C@H]1CC2)CCC(=O)C=3
|
|
MCULE-2208148247 |
0.70 |
[C@]12(C)CCC(C=C1CC[C@]1([H])[C@]2([H])CC[C@]2([C@@]1([H])CC[C@]2(O)C#N)C)=O
|
|
MCULE-1067345384 |
0.70 |
[C@]12(CO)C[C@@H]([C@]3([H])[C@@]4(C)CCC(=O)C=C4CC[C@@]3([H])[C@]1([H])CC[C@@H]2C(=O)CO)O
|
|
MCULE-9685581403 |
0.70 |
C1[C@@]2(C)C(CC[C@]3([H])[C@]2([H])CC[C@@]2(C)[C@@]3([H])CC[C@@]2(O)C#N)=CC(=O)C1
|
|
MCULE-9405848361 |
0.70 |
C12(C)CCC3C(CCC4=CC(=O)CCC43)C1CCC2(O)C#C
|
|
MCULE-2690578106 |
0.70 |
[C@]12(C)CCC(C=C1CC[C@]1([H])[C@]2([H])CC[C@]2([C@@]1([H])CC[C@@]2(O)C#C)C)=O
|
|
MCULE-4216254522 |
0.70 |
C12(C)CCC(C=C1CCC1C2CCC2(C1CCC2(O)C#C)C)=O
|
|
MCULE-7929024326 |
0.70 |
C1(O)C(=O)C=C(C)C2(CCC(C(O)(CO)C)C2)C1C
|
|
MCULE-7634595841 |
0.70 |
C1CC2(C)C(=O)C3(CC(C=C)(C)CC3O)CCC2C(C(=O)O)(C)C1
|
|
MCULE-9697672273 |
0.70 |
CC(OC(C1C2C=CC(CC2)C1)=O)(C)C
|
|
MCULE-1316925332 |
0.70 |
CC(OC(C1C2C=CC(CC2)C1)=O)C
|
|
MCULE-5029800865 |
0.70 |
CC(OC([C@H]1[C@H]2C=C[C@H](CC2)C1)=O)(C)C
|
|
MCULE-1988011337 |
0.70 |
CC(OC([C@H]1[C@H]2C=C[C@H](CC2)C1)=O)C
|
|
MCULE-1480805765 |
0.70 |
CCOC([C@H]1[C@H]2C=C[C@H](CC2)C1)=O
|
|
MCULE-3460278496 |
0.70 |
C12CCC(C=C1)CC2C(OCC)=O
|
|
MCULE-9579621162 |
0.70 |
C1C[C@]2(C)[C@@]3([H])C[C@H](O)C(C(C)C)=CC3=CC[C@@]2([H])[C@@](C(=O)O)(C)C1
|
|
MCULE-7899364914 |
0.70 |
[C@]12(CCC(=O)O)C[C@@]31CC[C@]1(C)[C@@]([H])([C@@H](CC/C=C(\C)/C=O)C)CC[C@@]1(C)[C@]3([H])CC[C@@]2([H])C(=C)CO
|
|
MCULE-4871834352 |
0.70 |
OC(C1(CC=CC1)CC1(CCCC1)O)=O
|
|
MCULE-2674225616 |
0.70 |
OC1C(C2(C(O)=O)CC=CC2)CCC1
|
|
MCULE-2363731744 |
0.70 |
C1(C)(C(CCC2(C)C1CC(=O)C=C2C)C)CC/C(/C)=C/C(O)=O
|
|
MCULE-3188056951 |
0.70 |
C1(=O)CC2C(C)(CCC(C2(C)CC/C(/C)=C\C(=O)O)C)C(C)=C1
|
|
MCULE-8431742814 |
0.70 |
O=C1C(C)CC(C)C(O)=C1
|
|
MCULE-8374913301 |
0.70 |
CC1(C(C2(C(O)=O)CC=CC2)CCC1)O
|
|
MCULE-4622236046 |
0.70 |
O=C(C1CCOCC1)CC1CC=CCC1
|
|
MCULE-2236994087 |
0.70 |
C1(CCC(CC=1)C(C)=C)C(O)=O
|
|
MCULE-2460476091 |
0.70 |
C1C[C@@]([H])(/C(/C)=C/C(=O)CC(C)C)CC=C1C(=O)O
|
|
MolPort-006-668-526 |
0.70 |
CC1CCC2(C)C(CC(=O)C=C2C)C1(C)CC\C(C)=C\C(O)=O
|
|
MolPort-001-740-574 |
0.70 |
CC1CCC2(C)C(CC(=O)C=C2C)C1(C)CC\C(C)=C/C(O)=O
|
|
MolPort-035-706-339 |
0.70 |
C[C@H](CC\C=C(/C)C=O)[C@H]1CC[C@@]2(C)[C@@H]3CC[C@@H](C(=C)CO)[C@@]4(CCC(O)=O)C[C@@]34CC[C@]12C
|
|
MolPort-001-791-998 |
0.70 |
OC(=O)C1=CCCCC1
|
|
MolPort-044-183-418 |
0.70 |
[Ca++].CCCCC[C@H](O)\C=C\[C@H]1[C@H](O)C[C@]2(C)C\C(C[C@H]12)=C/CCCC([O-])=O.CCCCC[C@H](O)\C=C/[C@H]1[C@H](O)C[C@]2(C)C\C(C[C@H]12)=C\CCCC([O-])=O
|
|
MolPort-006-118-969 |
0.70 |
CC(=C)C1CCC(=CC1)C(O)=O
|
|
MolPort-039-052-611 |
0.70 |
C[C@@H]1CC(=O)CC(C)(C)[C@@]1(O)\C=C\C(O)CO
|
|
MolPort-035-706-169 |
0.70 |
CC(C)CC(=O)\C=C(/C)[C@@H]1CCC(=CC1)C(O)=O
|
|
MolPort-046-071-645 |
0.69 |
OC(=O)CC1CC(=C)C1
|
|
MolPort-035-706-366 |
0.69 |
CC(C)C1=C2CC[C@]3(C)[C@H](CC[C@@H]4[C@@]5(C)CC[C@H](O)C(C)(C)[C@@H]5CC[C@@]34C)[C@@]2(C)CC1
|
|
MolPort-046-764-556 |
0.69 |
C[C@]12CC[C@@H]3[C@@H](CC[C@@H]4C[C@@H](O)CC[C@]34C)[C@H]1CC=C2
|
|
MolPort-002-509-734 |
0.69 |
[K+].[O-]C(=O)CCCCCCCCC=C
|
|
MolPort-006-709-371 |
0.69 |
C[C@]12CC[C@H]3[C@@H](CC[C@H]4C[C@@H](O)CC[C@]34C)[C@@H]1CC=C2
|
|
MolPort-046-691-207 |
0.69 |
CC(C)[C@@H](C)\C=C\[C@@H](C)[C@H]1CC[C@H]2C(=O)CCC[C@]12C
|
|
MolPort-046-647-152 |
0.69 |
OC(=O)C1CC2(C1)CC(=C)C2
|
|
MolPort-003-940-301 |
0.69 |
C[C@]12CC[C@H]3[C@@H](CC[C@H]4CC(=O)CC[C@]34C)[C@@H]1CC=C2
|
|
MolPort-003-666-886 |
0.69 |
[Zn++].[O-]C(=O)CCCCCCCCC=C.[O-]C(=O)CCCCCCCCC=C
|
|
MolPort-046-766-184 |
0.69 |
C[C@]12CC[C@@H]3[C@@H](CC[C@@H]4CC(O)CC[C@]34C)[C@H]1CC=C2
|
|
MolPort-046-068-912 |
0.69 |
CC(C)(O)CC[C@@H](O)C(C)(O)[C@H]1CC[C@@]2(O)C3=CC(=O)[C@@H]4C[C@@H](O)[C@@H](O)C[C@]4(C)[C@H]3CC[C@]12C
|
|
MolPort-020-005-976 |
0.69 |
C[C@@H](CO)CC[C@@H](O)[C@](C)(O)[C@H]1CC[C@@]2(O)C3=CC(=O)[C@@H]4C[C@@H](O)[C@@H](O)C[C@]4(C)[C@H]3CC[C@]12C
|
|
MolPort-046-509-001 |
0.69 |
CC(C)=CCC[C@H]([C@H]1[C@H](O)C[C@@]2(C)C3=CC[C@@H](C(C)=C)[C@](C)(CCC(O)=O)C3=CC[C@]12C)C(O)=O
|
|
MolPort-001-741-219 |
0.69 |
CC(C)(O)CC[C@@H](O)[C@](C)(O)[C@H]1CC[C@@]2(O)C3=CC(=O)[C@@H]4C[C@@H](O)[C@@H](O)C[C@]4(C)C3CC[C@]12C
|
|
MolPort-044-637-547 |
0.69 |
COC1C=C2[C@@H]3[C@@H](C)[C@H](C)CC[C@]3(C)CC[C@@]2(C)[C@]2(C)CCC3[C@](C)(CC[C@@H](O)[C@]3(C)C(O)=O)C12
|
|
MolPort-021-804-511 |
0.69 |
CC(CC(O)C(C)(O)C1CCC2(O)C3=CC(=O)C4CC(O)C(O)CC4(C)C3CCC12C)C(C)(O)CO
|
|
MolPort-039-338-087 |
0.69 |
CC(C)[C@@H](C)\C=C\[C@@H](C)[C@H]1CC[C@H]2C3=CC(=O)[C@@]4(O)C[C@@H](O)CC[C@]4(C)[C@H]3CC[C@]12C
|
|
MolPort-003-933-119 |
0.69 |
C[C@H]([C@H](O)CCC(C)(C)O)[C@H]1CC[C@@]2(O)C3=CC(=O)[C@@H]4C[C@@H](O)[C@@H](O)C[C@]4(C)[C@H]3CC[C@]12C
|
|
MolPort-001-741-221 |
0.69 |
C[C@H](C[C@@H](O)[C@](C)(O)[C@H]1CC[C@@]2(O)C3=CC(=O)[C@@H]4C[C@@H](O)[C@@H](O)C[C@]4(C)C3CC[C@]12C)C(C)(C)O
|
|
MolPort-001-569-826 |
0.69 |
CO[C@H]1C=C2C(CC[C@@H]3C[C@H](O)CC[C@]23C)C2CCC(C(C)CCC(=O)OC)[C@@]12C
|
|
MolPort-005-933-631 |
0.69 |
C[C@H]([C@H](O)CCC(C)(C)O)[C@H]1CC[C@@]2(O)C3=CC(=O)[C@@H]4C[C@@H](O)[C@@H](O)C[C@]4(C)C3CC[C@]12C
|
|
MolPort-020-005-977 |
0.69 |
C[C@H](CO)CC[C@@H](O)[C@](C)(O)[C@H]1CC[C@@]2(O)C3=CC(=O)[C@@H]4C[C@@H](O)[C@@H](O)C[C@]4(C)[C@H]3CC[C@]12C
|
|
MolPort-044-561-113 |
0.69 |
C[C@H](C[C@@H](O)[C@](C)(O)[C@H]1CC[C@@]2(O)C3=CC(=O)[C@@H]4C[C@@H](O)[C@@H](O)C[C@]4(C)[C@H]3CC[C@]12C)C(C)(C)O
|
|
MolPort-046-054-510 |
0.69 |
CC(C)(O)CC[C@@H](O)C(C)(O)C1CC[C@@]2(O)C3=CC(=O)C4CC(O)C(O)CC4(C)C3CCC12C
|
|
MolPort-009-019-228 |
0.69 |
OC(CC1CCCCC1)\C=C\[C@H]1C(O)CC(=O)[C@H]1C\C=C/CCCC(O)=O
|
|
MolPort-046-067-789 |
0.69 |
CC(C)(O)CC[C@H](O)C(C)(O)[C@H]1CC[C@@]2(O)C3=CC(=O)C4C[C@H](O)C(O)C[C@]4(C)C3CC[C@]12C
|
|
MolPort-000-728-523 |
0.69 |
CC(C)(O)CC[C@@H](O)[C@](C)(O)[C@H]1CC[C@@]2(O)C3=CC(=O)[C@@H]4C[C@@H](O)[C@@H](O)CC4(C)[C@H]3CCC12C
|
|
MolPort-002-911-165 |
0.69 |
C[C@]1(O)CCC2C3C=CC4=CC(=O)CCC4(C)C3CCC12C
|
|
MolPort-046-153-164 |
0.69 |
CC(CCC(O)C(C)(C)O)C1CC(O)C2(C)C3=CCC4C(C)(C)C(=O)CCC4(C)C3=CCC12C
|
|
MolPort-027-853-691 |
0.69 |
CC(C)[C@@H](C)C[C@@H](O)[C@](C)(O)C1CC[C@@]2(O)C3=CC(=O)C4C[C@@H](O)[C@@H](O)C[C@]4(C)C3CC[C@]12C
|
|
MolPort-001-741-468 |
0.69 |
CC(C)(O)CCC(=O)[C@](C)(O)C1[C@H](O)C[C@@]2(C)C3CC=C4C(C[C@H](O)[C@@H](O)C4(C)C)[C@]3(C)C(=O)C[C@]12C
|
|
MolPort-002-509-604 |
0.69 |
CO[C@H]1C=C2C(CCC3C[C@H](O)CC[C@]23C)C2CCC(C(C)CCC(=O)OC)[C@@]12C
|
|
MolPort-039-338-665 |
0.69 |
CC(CO)CC[C@@H](O)[C@](C)(O)[C@H]1CC[C@@]2(O)C3=CC(=O)[C@@H]4C[C@@H](O)[C@@H](O)C[C@]4(C)[C@H]3CC[C@]12C
|
|
MolPort-008-322-993 |
0.69 |
CC(C)(O)CCC(O)C(C)(O)C1CCC2(O)C3=CC(=O)C4CC(O)C(O)CC4(C)C3CCC12C
|
|
MolPort-002-507-287 |
0.69 |
CC(C)(O)CC[C@@H](O)[C@](C)(O)[C@H]1CC[C@@]2(O)C3=CC(=O)[C@@H]4C[C@@H](O)[C@@H](O)C[C@]4(C)[C@H]3CC[C@]12C
|
|
MolPort-046-693-458 |
0.69 |
CC(C)CC[C@@H](O)C(C)(O)[C@H]1CC[C@@]2(O)C3=CC(=O)[C@@H]4C[C@@H](O)[C@@H](O)C[C@]4(C)[C@H]3CC[C@]12C
|
|
MolPort-006-822-587 |
0.69 |
CC(C)CC[C@@H](O)[C@](C)(O)[C@H]1CC[C@@]2(O)C3=CC(=O)[C@@H]4C[C@@H](O)[C@@H](O)C[C@]4(C)[C@H]3CC[C@]12C
|
|
MolPort-020-005-739 |
0.69 |
CC(C)(O)CCC(=O)[C@](C)(O)[C@H]1[C@H](O)C[C@@]2(C)[C@@H]3CC=C4[C@@H](C[C@H](O)[C@@H](O)C4(C)C)[C@]3(C)C(=O)C[C@]12C
|
|
MolPort-039-338-507 |
0.69 |
CC(C)C(=C)CC[C@H]([C@H]1[C@H](O)C[C@@]2(C)C3=CC[C@@H](C(C)=C)[C@](C)(CCC(O)=O)C3=CC[C@]12C)C(O)=O
|
|
MolPort-002-508-947 |
0.69 |
CC(C)(O)CC[C@@H](O)[C@](C)(O)[C@H]1CC[C@@]2(O)C3=CC(=O)[C@@H]4C[C@@H](O)[C@H](O)C[C@]4(C)C3CC[C@]12C
|
|
MolPort-039-338-963 |
0.69 |
C[C@H](CC(=O)C=C(C)C)[C@H]1CC[C@@]2(C)[C@@H]3[C@@H](O)C=C4[C@@H](CC[C@H](O)C4(C)C)[C@@]3(CC[C@]12C)C=O
|
|
MolPort-002-506-883 |
0.69 |
CC[C@@H](CC[C@@H](C)[C@H]1CCC2[C@@H]3CC=C4C[C@H](O)CC[C@]4(C)C3CC[C@]12C)C(C)C
|
|
MolPort-002-506-911 |
0.69 |
CC(C)CCC[C@@H](C)[C@H]1CC[C@H]2[C@@H]3CC=C4C[C@@H](O)CC[C@]4(C)[C@H]3CC[C@]12C
|
|
MolPort-046-689-114 |
0.69 |
[2H]C([2H])([2H])C([2H])(C)CCC[C@@H](C)[C@H]1CC[C@H]2[C@@H]3CC=C4C[C@@H](O)CC[C@]4(C)[C@H]3CC[C@]12C
|
|
MolPort-044-754-061 |
0.69 |
CC[C@@H](CC[C@@H](C)[C@H]1CC[C@H]2[C@@H]3CC=C4C[C@@H](O)CC[C@]4(C)[C@H]3CC[C@]12C)C(C)=C
|
|
MolPort-002-506-888 |
0.69 |
C[C@]1(O)CCC2C3CC=C4C[C@@H](O)CC[C@]4(C)C3CC[C@]12C
|
|
MolPort-044-755-201 |
0.69 |
C[C@@]12CCC[C@H]1[C@@H]1CC=C3C[C@@H](O)CC[C@]3(C)[C@H]1CC2
|
|
MolPort-044-560-209 |
0.69 |
C[C@H](CCCC(C)(C)O)[C@H]1CC[C@H]2[C@@H]3CC=C4CC(O)CC[C@]4(C)[C@H]3CC[C@]12C
|
|
MolPort-006-394-722 |
0.69 |
[2H]C([2H])([2H])C([2H])(CCC[C@@H](C)[C@H]1CC[C@H]2[C@@H]3CC=C4CC(=O)CC[C@]4(C)[C@H]3CC[C@]12C)C([2H])([2H])[2H]
|
|
MolPort-003-934-737 |
0.69 |
[2H]C1=C2C([2H])([2H])[C@@]([2H])(O)C([2H])([2H])C[C@]2(C)[C@H]2CC[C@]3(C)[C@H](CC[C@H]3[C@@H]2C1)[C@H](C)CCCC(C)C
|
|
MolPort-003-940-755 |
0.69 |
CC(C)[C@@H](C)CC[C@@H](C)[C@H]1CC[C@H]2[C@@H]3CC=C4C[C@@H](O)CC[C@]4(C)[C@H]3CC[C@]12C
|
|
MolPort-001-535-945 |
0.69 |
CC(C)CCCC(C)C1CCC2C3CC=C4CC(O)CCC4(C)C3CCC12C
|
|
MolPort-021-804-488 |
0.69 |
CC12CCC(CC1C(=C)CC(O)C2)C(=C)C(O)=O
|
|
MolPort-046-687-433 |
0.69 |
CC(C)[C@@H]1CC[C@@]2(C)CC[C@@]3(C)[C@@H]4CC=C5[C@@H](CC[C@H](O)C5(C)C)[C@]4(C)CC[C@]3(C)[C@@H]12
|
|
MolPort-044-183-267 |
0.69 |
C[C@H](CO)CCC[C@@H](C)[C@H]1CC[C@H]2[C@@H]3CC=C4C[C@@H](O)CC[C@]4(C)[C@H]3CC[C@]12C
|
|
MolPort-044-727-592 |
0.69 |
[2H]C([2H])([2H])C(O)(CCC[C@@H](C)[C@H]1CC[C@H]2[C@@H]3CC=C4C[C@@H](O)CC[C@]4(C)[C@H]3CC[C@]12C)C([2H])([2H])[2H]
|
|
MolPort-042-624-515 |
0.69 |
C[C@@H](CO)CCC[C@@H](C)[C@H]1CC[C@H]2[C@@H]3CC=C4C[C@@H](O)CC[C@]4(C)[C@H]3CC[C@]12C
|
|
MolPort-003-940-820 |
0.69 |
CC(C)CCC[C@@H](C)[C@H]1CC[C@H]2[C@@H]3CC=C4CC(=O)CC[C@]4(C)[C@H]3CC[C@]12C
|
|
MolPort-003-941-681 |
0.69 |
CC(C)CC[C@H](O)[C@@H](C)[C@H]1CC[C@H]2[C@@H]3CC=C4C[C@@H](O)CC[C@]4(C)[C@H]3CC[C@]12C
|
|
MolPort-001-790-211 |
0.69 |
O=C1CCC2CCCCC2=C1
|
|
MolPort-046-693-545 |
0.69 |
[2H]C([2H])([2H])C([2H])(C(O)CC[C@@H](C)[C@H]1CC[C@H]2[C@@H]3CC=C4C[C@@H](O)CC[C@]4(C)[C@H]3CC[C@]12C)C([2H])([2H])[2H]
|
|
MolPort-009-199-159 |
0.69 |
CC(C)CCC[C@@H](C)[C@H]1CC[C@H]2[C@@H]3CC=C4CC(O)CC[C@]4(C)[C@H]3CC[C@]12C
|
|
MolPort-039-052-668 |
0.69 |
CC1(C)CC[C@]2(C)CC[C@]3(C)C(=CC(=O)[C@@H]4[C@@]5(C)CCC(=O)C(C)(C)[C@@H]5CC[C@@]34C)[C@@H]2C1
|
|
MolPort-000-697-037 |
0.69 |
CC(C)CCCC(C)C1CC[C@H]2C3CC=C4CC(O)CCC4(C)[C@H]3CCC12C
|
|
MolPort-044-562-009 |
0.69 |
CC(C)[C@@H](O)CC[C@@H](C)[C@H]1CC[C@H]2[C@@H]3CC=C4C[C@@H](O)CC[C@]4(C)[C@H]3CC[C@]12C
|
|
MolPort-003-941-744 |
0.69 |
CC(C)CC[C@@H](O)[C@@H](C)[C@H]1CC[C@H]2[C@@H]3CC=C4C[C@@H](O)CC[C@]4(C)[C@H]3CC[C@]12C
|
|
MolPort-003-941-696 |
0.69 |
CC(C)CCC[C@](C)(O)[C@H]1CC[C@H]2[C@@H]3CC=C4C[C@@H](O)CC[C@]4(C)[C@H]3CC[C@]12C
|
|
MolPort-004-956-055 |
0.69 |
CC[C@H](\C=C\[C@@H](C)[C@H]1CC[C@H]2[C@@H]3CC=C4C[C@@H](O)CC[C@]4(C)[C@H]3CC[C@]12C)C(C)C
|
|
MolPort-005-938-581 |
0.69 |
CCC(\C=C\C(C)[C@H]1CCC2C3CC=C4C[C@@H](O)CC[C@]4(C)C3CC[C@]12C)C(C)C
|
|
MolPort-046-703-371 |
0.69 |
CC(C)C(O)CCC(C)C1CCC2C3CC=C4CC(O)CCC4(C)C3CCC12C
|
|
MolPort-046-690-010 |
0.69 |
CC(C)CCCC(C)(O)[C@H]1CC[C@H]2[C@@H]3CC=C4C[C@@H](O)CC[C@]4(C)[C@H]3CC[C@]12C
|
|
MolPort-003-941-119 |
0.69 |
C[C@H](CCC=C(C)C)[C@H]1CC[C@H]2[C@@H]3CC=C4C[C@@H](O)CC[C@]4(C)[C@H]3CC[C@]12C
|
|
MolPort-006-666-182 |
0.69 |
CCC(CCC(C)C1CCC2C3CC=C4CC(O)CCC4(C)C3CCC12C)C(C)C
|
|
MolPort-046-689-497 |
0.69 |
C[C@H](O)[C@H]1CC[C@H]2[C@@H]3CC=C4C[C@@H](O)CC[C@]4(C)[C@H]3CC[C@]12C
|
|
MolPort-046-689-405 |
0.69 |
[2H]C([2H])([2H])C(=CCC[C@@H](C)[C@H]1CC[C@H]2[C@@H]3CC=C4C[C@@H](O)CC[C@]4(C)[C@H]3CC[C@]12C)C([2H])([2H])[2H]
|
|
MolPort-046-761-538 |
0.69 |
[2H]C([2H])([2H])C([2H])(CCCC(C)(O)[C@H]1CC[C@H]2[C@@H]3CC=C4C[C@@H](O)CC[C@]4(C)[C@H]3CC[C@]12C)C([2H])([2H])[2H]
|
|
MolPort-001-785-933 |
0.69 |
CC1(O)CCC2C3CC=C4CC(O)CCC4(C)C3CCC12C
|
|
MolPort-006-069-169 |
0.69 |
C[C@@H](O)[C@H]1CC[C@H]2[C@@H]3CC=C4C[C@@H](O)CC[C@]4(C)[C@H]3CC[C@]12C
|
|
MolPort-044-830-320 |
0.69 |
CC(C)C(=C)CC[C@@H](C)[C@H]1CC[C@H]2[C@@H]3CC=C4C[C@@H](O)CC[C@]4(C)[C@H]3CC[C@]12C
|
|
MolPort-006-111-384 |
0.69 |
CC(C)[C@H](C)CC[C@@H](C)[C@H]1CC[C@H]2[C@@H]3CC=C4C[C@@H](O)CC[C@]4(C)[C@H]3CC[C@]12C
|
|
MolPort-039-338-303 |
0.69 |
C[C@@H]1CC[C@]2(C)[C@H](C[C@H](O)C=C2C)[C@@]1(C)CC[C@@](C)(O)C=C
|
|
MolPort-046-153-784 |
0.69 |
CC1(C)C[C@H]2C3=CC[C@@H]4[C@@]5(C)CC[C@H](O)[C@](C)(CO)[C@@H]5CC[C@@]4(C)[C@]3(C)CC[C@@]2(C)[C@H](O)[C@@H]1O
|
|
MolPort-002-799-485 |
0.69 |
CC1(C)CCC[C@]2(C)[C@H](O)C=CC[C@@H]12
|
|
MolPort-039-052-643 |
0.69 |
CC1(C)CC[C@]2(C)CC[C@]3(C)C(=C[C@@H](O)[C@@H]4[C@@]5(C)CC[C@H](O)C(C)(C)[C@@H]5CC[C@@]34C)[C@@H]2C1
|
|
MolPort-006-169-893 |
0.69 |
C[C@H](CCCC(C)(C)O)[C@H]1CC[C@H]2[C@@H]3CC=C4C[C@@H](O)CC[C@]4(C)[C@H]3CC[C@]12C
|
|
MolPort-035-706-328 |
0.69 |
CC(C)[C@H]1CC[C@@H]2[C@]1(C)CC[C@]1(C)[C@H]3CC=C4[C@@H](CC[C@H](O)C4(C)C)[C@]3(C)CC[C@@]21C
|
|
MolPort-035-706-329 |
0.69 |
CC(C)[C@H]1CC[C@@H]2[C@]1(C)CC[C@]1(C)[C@H]3CC=C4[C@@H](CCC(=O)C4(C)C)[C@]3(C)CC[C@@]21C
|
|
MolPort-006-169-892 |
0.69 |
CC(C)CCC[C@@](C)(O)[C@H]1CC[C@H]2[C@@H]3CC=C4C[C@@H](O)CC[C@]4(C)[C@H]3CC[C@]12C
|
|
MolPort-002-530-568 |
0.69 |
CC[C@@H](\C=C\[C@@H](C)[C@H]1CC[C@H]2[C@@H]3CC=C4C[C@@H](O)CC[C@]4(C)[C@H]3CC[C@]12C)C(C)C
|
|
MolPort-046-196-386 |
0.69 |
C[C@]12CC[C@H]3[C@@H](CC=C4C[C@H](O)CC[C@]34C)[C@@H]1CC[C@@H]2O
|
|
MolPort-002-511-291 |
0.69 |
CC(C)C1CC(=O)C=C2CCCCC12
|
|
MolPort-046-764-571 |
0.69 |
C[C@@H](O)[C@@H]1CC[C@@H]2[C@@H]3CC=C4C[C@@H](O)CC[C@]4(C)[C@@H]3CC[C@]12C
|
|
MolPort-046-418-687 |
0.69 |
CC(C)C(O)CC[C@@H](C)[C@H]1CC[C@H]2[C@@H]3CC=C4C[C@@H](O)CC[C@]4(C)[C@H]3CC[C@]12C
|
|
MolPort-046-426-779 |
0.69 |
[2H]C([2H])([2H])C(CCC[C@@H](C)[C@H]1CC[C@H]2[C@@H]3CC=C4C[C@@H](O)CC[C@]4(C)[C@H]3CC[C@]12C)C([2H])([2H])[2H]
|
|
MolPort-002-525-884 |
0.69 |
C[C@]1(O)CCC2[C@@H]3CC=C4C[C@@H](O)CC[C@]4(C)C3CC[C@]12C
|
|
MolPort-046-764-597 |
0.69 |
[2H]C([2H])([2H])C([2H])(C(C)CC[C@@H](C)[C@H]1CC[C@H]2[C@@H]3CC=C4C[C@@H](O)CC[C@]4(C)[C@H]3CC[C@]12C)C([2H])([2H])[2H]
|
|
MolPort-046-509-053 |
0.69 |
CC1(C)C[C@H]2C3=CC[C@@H]4[C@@]5(C)CC[C@H](O)[C@@](C)(CO)[C@@H]5CC[C@@]4(C)[C@]3(C)C[C@H](O)[C@@]2(CO)C[C@@H]1O
|
|
MolPort-046-764-598 |
0.69 |
[2H]C([2H])(CC(C)[C@@H]1CC[C@@H]2[C@@H]3CC=C4C[C@@H](O)CC[C@]4(C)C3CC[C@]12C)C([2H])(O)C([2H])(C)C
|
|
MolPort-002-524-763 |
0.69 |
CC[C@H](CC[C@@H](C)[C@H]1CCC2[C@@H]3CC=C4CC(=O)CC[C@]4(C)C3CC[C@]12C)C(C)C
|
|
MolPort-046-764-702 |
0.69 |
C[C@]12CC[C@@H](O)CC1=CC[C@H]1[C@H]3CC[C@H](O)C3CC[C@@H]21
|
|
MolPort-003-892-585 |
0.69 |
CCC(\C=C\C(C)C1CCC2C3CC=C4CC(O)CCC4(C)C3CCC12C)C(C)C
|
|
MolPort-039-338-727 |
0.69 |
C[C@H](CCC=C(C)C)[C@H]1CC[C@@]2(C)[C@@H]3CC=C4[C@@H](CC[C@H](O)C4(C)C)[C@]3(C)CC[C@]12C
|
|
MolPort-044-183-170 |
0.69 |
CC(C)[C@H](O)CC[C@@H](C)[C@H]1CC[C@H]2[C@@H]3CC=C4C[C@@H](O)CC[C@]4(C)[C@H]3CC[C@]12C
|
|
MolPort-039-339-159 |
0.69 |
CC(CO)CCC[C@@H](C)[C@H]1CC[C@H]2[C@@H]3CC=C4C[C@@H](O)CC[C@]4(C)[C@H]3CC[C@]12C
|
|
MolPort-044-830-522 |
0.69 |
C\C=C(/CC[C@@H](C)[C@H]1CC[C@H]2[C@@H]3CC=C4C[C@@H](O)CC[C@]4(C)[C@H]3CC[C@]12C)C(C)C
|
|
MolPort-046-773-764 |
0.69 |
[2H]C([2H])([2H])C(CCC[C@@H](C)C1CCC2C3CC=C4C[C@@H](O)CC[C@]4(C)C3CC[C@]12C)C([2H])([2H])[2H]
|
|
MolPort-003-850-254 |
0.69 |
[2H]C([2H])([2H])C([2H])(C(CC)CC[C@@H](C)[C@H]1CC[C@H]2[C@@H]3CC=C4C[C@@H](O)CC[C@]4(C)[C@H]3CC[C@]12C)C([2H])([2H])[2H]
|
|
MolPort-046-033-528 |
0.69 |
CC[C@@H](\C=C\[C@H](C)[C@H]1CC[C@H]2[C@@H]3CC=C4C[C@@H](O)CC[C@]4(C)[C@H]3CC[C@]12C)C(C)C
|
|
MolPort-039-338-463 |
0.69 |
C[C@H]1[C@H]2C3=CC[C@@H]4[C@@]5(C)CC[C@H](O)C(C)(C)[C@@H]5CC[C@@]4(C)[C@]3(C)C[C@H](O)[C@@]2(C)CCC1=C
|
|
MolPort-044-183-187 |
0.69 |
[2H]C([2H])([2H])C(O)(CCC[C@@H](C)C1CCC2C3CC=C4C[C@@H](O)CC[C@]4(C)C3CC[C@]12C)C([2H])([2H])[2H]
|
|
MolPort-046-682-865 |
0.69 |
CC(C)CCC[C@@](C)(O)[C@H]1CC[C@H]2[C@@H]3CC=C4CC(O)CC[C@]4(C)[C@H]3CC[C@]12C
|
|
MolPort-046-762-692 |
0.69 |
CC(C)[C@H](C)CC[C@H](C)[C@@H]1CC[C@@H]2[C@@H]3CC=C4C[C@@H](O)CC[C@]4(C)[C@@H]3CC[C@]12C
|
|
MolPort-027-640-632 |
0.69 |
CC(C)CCC[C@H](C)[C@H]1CC[C@H]2[C@@H]3CC=C4CC(=O)CC[C@]4(C)[C@H]3CC[C@]12C
|
|
MolPort-023-331-232 |
0.69 |
C\C=C(\CC[C@@H](C)[C@H]1CC[C@H]2[C@@H]3CC=C4C[C@@H](O)CC[C@]4(C)[C@H]3CC[C@]12C)C(C)C
|
|
MolPort-006-393-281 |
0.69 |
[2H]C([2H])([2H])C([2H])(CCC[C@@H](C)[C@H]1CC[C@H]2[C@@H]3CC=C4C[C@@H](O)CC[C@]4(C)[C@H]3CC[C@]12C)C([2H])([2H])[2H]
|
|
MolPort-035-882-121 |
0.69 |
CC(C)[C@@H](C)\C=C\[C@@H](C)[C@H]1CC[C@H]2[C@@H]3CC=C4C[C@@H](O)CC[C@]4(C)[C@H]3CC[C@]12C
|
|
MolPort-046-762-734 |
0.69 |
CC(C)CCC[C@@H](C)[C@H]1CC[C@@H]2[C@@H]3CC=C4CC(=O)CC[C@]4(C)[C@@H]3CC[C@]12C
|
|
MolPort-020-173-604 |
0.69 |
O=C1CCC2(CCCCC2)C=C1
|
|
MolPort-001-742-476 |
0.69 |
CC[C@H](CC[C@@H](C)[C@H]1CC[C@H]2[C@@H]3CC=C4C[C@@H](O)CC[C@]4(C)[C@H]3CC[C@]12C)C(C)C
|
|
MCULE-8671525222 |
0.69 |
C(CCCCCCCCC=C)(=O)[O-].[K+]
|
|
MCULE-3639141823 |
0.69 |
CC(C1(CC1)CC1CC=CCC1)=O
|
|
MCULE-4878329713 |
0.69 |
O=CC1(CC1)CC1CC=CCC1
|
|
MCULE-6807015507 |
0.69 |
OC1C(CC2CC=CCC2)CCC1
|
|
MCULE-8979245765 |
0.69 |
O=C1C(CC2CC=CCC2)CCC1
|
|
MCULE-2076771260 |
0.69 |
O=C1CC(CC2CC=CCC2)CCCC1
|
|
MCULE-6811826956 |
0.69 |
C12(C)CCC(=O)CC1CCC1C3C(CCC21)=C(C)CC3
|
|
MCULE-7116827600 |
0.69 |
O=CC1(CCC1)CC1CC=CCC1
|
|
MCULE-5395136417 |
0.69 |
[H]C1(C)C2(CCC3(C)C(C(C)C=CC(C)C(C)C)CCC3C2CCC1=O)[H]
|
|
MCULE-5343555845 |
0.69 |
OC1CC(CC2CC=CCC2)CC1
|
|
MCULE-7908633302 |
0.69 |
CC1C(C=O)(CC2CC=CCC2)CCC1
|
|
MCULE-9608185744 |
0.69 |
CC1CC(C=O)(CC2CC=CCC2)CC1
|
|
MCULE-7459604539 |
0.69 |
O=C1C(CC2CC=CCC2)CCCCC1
|
|
MCULE-4641005233 |
0.69 |
O=CC1(CCCC1)CC1CC=CCC1
|
|
MCULE-3486573074 |
0.69 |
CC1C(=O)CCC1CC1CC=CCC1
|
|
MCULE-3707649630 |
0.69 |
C(=O)(C=C)CCCCCC(=O)O
|
|
MCULE-1031499239 |
0.69 |
CC1(CC(=O)CC1)CC1CC=CCC1
|
|
MCULE-7656108129 |
0.69 |
CC1C(CC2CC=CCC2)CCC1O
|
|
MCULE-2997369368 |
0.69 |
CC1(CC(O)CC1)CC1CC=CCC1
|
|
MCULE-5396685230 |
0.69 |
C12=CC(C3([H])CC(O)C(O)CC3(C)C1([H])CCC1(C)C(CCC21O)C(C)C(O)CCC(O)(C)C)=O
|
|
MCULE-5339139192 |
0.69 |
[C@@]1(C(C)=C)([H])CC=C2[C@]3(C)C[C@@H](O)[C@H]([C@@H](CCC(=C)C(C)C)C(O)=O)[C@@]3(C)CC=C2[C@]1(CCC(=O)O)C
|
|
MCULE-4167735225 |
0.69 |
C12=CC([C@]3([H])C[C@@H](O)[C@@H](O)C[C@]3(C)[C@@]1([H])CC[C@]1(C)[C@H](CC[C@@]21O)[C@H](C)[C@H](O)CCC(O)(C)C)=O
|
|
MCULE-4797309594 |
0.69 |
[C@@H]1(C[C@@]2([C@@]3([H])CC[C@@]4([C@]([H])(CC[C@@]4(O)C3=CC([C@]2([H])C[C@H]1O)=O)[C@@](C)(O)[C@H](O)CC[C@@H](C)CO)C)C)O
|
|
MCULE-7541730655 |
0.69 |
CC1(C)C2=CCC3C4(C)CC(O)C(C(O)(C(CCC(O)(C)C)=O)C)C4(C)CC(=O)C3(C)C2CC(O)C1O
|
|
MCULE-1695863761 |
0.69 |
C12C(CCC3([H])CC(O)CCC13C)C1CCC(C(C)CCC(OC)=O)C1(C(OC)C=2)C
|
|
MCULE-2754580936 |
0.69 |
C/C(/C)=C/CC([C@H](C(C)=O)[C@@H]1[C@@]2(C)CC=C3[C@@]4(C)CC[C@H](O)C(C)(C)[C@@H]4CC=C3[C@]2(C)C[C@@H]1O)=C
|
|
MCULE-1963273832 |
0.69 |
[C@@H]1(C[C@@]2(C3CC[C@]4([C@@](CC[C@@H]4[C@@]([C@H](O)C[C@@H](C)C(O)(C)C)(C)O)(C3=CC([C@]2([H])C[C@H]1O)=O)O)C)C)O
|
|
MCULE-8466128773 |
0.69 |
[C@H]1(O)C[C@]2(C)C3CC[C@]4(C)[C@@H]([C@@H]([C@H](O)CCC(O)(C)C)C)CC[C@@]4(O)C3=CC(=O)[C@]2([H])C[C@H]1O
|
|
MCULE-1821855723 |
0.69 |
C1(CC2(C3CCC4(C(CCC4C(C(O)CC(C)C(O)(C)CO)(C)O)(C3=CC(C2CC1O)=O)O)C)C)O
|
|
MCULE-1655274985 |
0.69 |
C12=CC(=O)C3C(C)(CC(C(O)C3)O)C1CCC1(C)C(CCC21O)C(C)(O)C(O)CCC(C)(C)O
|
|
MCULE-4479203479 |
0.69 |
[C@H]1(O)C[C@]2(C)[C@@]3([H])CC[C@]4(C)[C@@]([H])([C@@](O)([C@H](O)CCC(O)(C)C)C)CC[C@@]4(O)C3=CC(=O)[C@]2([H])C[C@H]1O
|
|
MCULE-3121556913 |
0.69 |
[C@H]1(O)C[C@]2(C)[C@@]3([H])CC[C@]4(C)[C@@]([H])([C@@](C)(O)[C@H](O)CCC(C)CO)CC[C@@]4(O)C3=CC(=O)[C@]2([H])C[C@H]1O
|
|
MCULE-5643440248 |
0.69 |
[C@@H]1(C[C@@]2([C@@]3([H])CC[C@@]4([C@]([H])(CC[C@@]4(O)C3=CC([C@]2([H])C[C@H]1O)=O)[C@@](C)(O)[C@H](O)CC[C@H](C)CO)C)C)O
|
|
MCULE-9660893096 |
0.69 |
C12=CC(=O)[C@]3([C@](C)(C[C@@H]([C@H](O)C3)O)[C@@]1([H])CC[C@]1(C)[C@@](CC[C@@]21O)([H])[C@@](C)(O)[C@H](O)CCC(C)(C)O)[H]
|
|
MCULE-5733786329 |
0.69 |
C(C(=O)O)C[C@]1(C)C2=CC[C@]3(C)[C@@]([H])([C@H](C(=O)O)CC/C=C(/C)\C)[C@H](O)C[C@@]3(C)C2=CC[C@@]1([H])C(=C)C
|
|
MCULE-6132152847 |
0.69 |
[C@H]1(O)C[C@]2(C)C3CC[C@]4(C)C([C@@](O)([C@H](O)C[C@H](C)C(C)C)C)CC[C@@]4(O)C3=CC(=O)C2C[C@H]1O
|
|
MCULE-5549887798 |
0.69 |
C12C(CCC3([H])C[C@H](O)CC[C@]13C)C1CCC(C(C)CCC(OC)=O)[C@]1([C@@H](OC)C=2)C
|
|
MCULE-4964860916 |
0.69 |
C12=CC(C3([H])CC(O)C(O)CC3(C)C1([H])CCC1(C)C(CCC21O)C(O)(C)C(O)CCC(C)C)=O
|
|
MCULE-3979294448 |
0.69 |
[C@H]1(O)C[C@]2(C)[C@@]3([H])CC[C@]4(C)[C@@]([H])([C@@](C)(O)[C@H](O)CCC(C)C)CC[C@@]4(O)C3=CC(=O)[C@]2([H])C[C@H]1O
|
|
MCULE-8972335438 |
0.69 |
O=C1[C@]2(C)[C@](CC=C3[C@@]2([H])C[C@H](O)[C@@H](O)C3(C)C)([H])[C@@]2(C)[C@]([C@H]([C@@H](C2)O)[C@@](C)(O)C(=O)CCC(C)(O)C)(C)C1
|
|
MCULE-9418551163 |
0.69 |
C12(C)C(O)(CCC1C1C(CC2O)C2(C)CCC(C=C2CC1)=O)C#N
|
|
MCULE-3331110138 |
0.69 |
C1C[C@]2(C)[C@@]3([H])CC[C@]4(C)[C@@]([H])([C@@H](/C=C/[C@H](C)C(C)C)C)CC[C@@]4([H])C3=CC(=O)[C@@]2(O)C[C@H]1O
|
|
MCULE-7633282937 |
0.69 |
C1CC2(C)C3=CCC4(C)C(C(CCC(O)C(O)(C)C)C)CC(O)C4(C)C3=CCC2C(C)(C)C1=O
|
|
MCULE-6086039312 |
0.69 |
O=C1C2(O)C(C)(CCC(O)C2)C2(CCC3(C)C(C(C)C=CC(C)C(C)C)CCC3C2=C1)[H]
|
|
MCULE-8423145149 |
0.69 |
[C@@]12([H])CC[C@H]([C@H](C)CCCC(O)(C)C)[C@@]1(C)CC[C@]1([H])[C@@]3(C)CC[C@H](O)CC3=CC[C@@]21[H]
|
|
MCULE-9644532124 |
0.69 |
[C@@H]1(O)CC2[C@](C)(CC1)[C@]1([H])[C@]([H])([C@@]3([H])[C@@](CC1)(C)[C@@H]([C@H](C)CCC(O)C(C)C)CC3)CC=2
|
|
MCULE-1925425954 |
0.69 |
C12CCCCC1CCC(=O)C=2
|
|
MCULE-5523061914 |
0.69 |
C1(O)CC2[C@](C)(CC1)[C@]1([H])[C@]([H])([C@@]3([H])[C@@](CC1)(C)[C@@H]([C@H](C)[C@H](O)CCC(C)C)CC3)CC=2
|
|
MCULE-9819330201 |
0.69 |
[C@@]12([H])CC[C@H]([C@H](C)CCC[C@@H](C)CO)[C@@]1(C)CC[C@]1([H])[C@@]3(C)CC[C@H](O)CC3=CC[C@@]21[H]
|
|
MCULE-8599123114 |
0.69 |
C12(C)CCCCC1=C(C)C(=O)CC2
|
|
MCULE-3896942700 |
0.69 |
C1C[C@]2(C)[C@@]3([H])CC[C@]4(C)[C@@]([H])([C@@H](CCCC(C)CO)C)CC[C@@]4([H])[C@]3([H])CC=C2C[C@H]1O
|
|
MCULE-5784478301 |
0.69 |
C12(C)CCC3C(CC=C4CC(O)CCC34C)C1CCC2C(C)CCCC(C)C
|
|
MCULE-8358015855 |
0.69 |
C1C[C@]2(C)[C@@]3([H])CC[C@]4(C)[C@@]([H])([C@@H](CCCC(C)C)C)CC[C@@]4([H])[C@]3([H])CC=C2C[C@H]1O
|
|
MCULE-7911152718 |
0.69 |
O=C1CCC2(C)C3CCC4(C)CCCC4C3CC=C2C1(C)C
|
|
MCULE-4587768251 |
0.69 |
[H]C12CC(O)CCC1(C)C1(C)C(O)CC3(C)C(C(C)C=CC(C)C(C)C)CCC3C1=CC2
|
|
MCULE-3926742898 |
0.69 |
O=C1C=CC2(CCCCC2)CC1
|
|
MCULE-2409753351 |
0.69 |
[C@]12(C)CC[C@]3([C@@]([H])(CC=C4C[C@@H](O)CC[C@]34C)[C@]1([H])CC[C@@H]2[C@H](C)CC[C@@H](CC)C(C)C)[H]
|
|
MCULE-1713939889 |
0.69 |
C12CC(O)(C)CCC1(C)C1CCC3(C)C(C(C)CCCC(C)C)CCC3C1CC=2
|
|
MCULE-5815266173 |
0.69 |
C1(CCC(=C)C1(C)C)C(=O)C(O)=O
|
|
MCULE-7781678672 |
0.69 |
C12CCCCC1C(CC(=O)C=2)C(C)C
|
|
MCULE-1216746738 |
0.69 |
[C@@]12([H])CC[C@H]([C@H](C)CCCC(O)(C)C)[C@@]1(C)CC[C@]1([H])[C@@]3(C)CC[C@H](O)CC3=CC[C@@]21[H]
|
|
MCULE-6265228650 |
0.69 |
C12(C)CCC3C(CC=C4CC(O)CCC34C)C1CCC2C(C)CCC(CC)C(C)C
|
|
MCULE-5631441050 |
0.69 |
C12CCCCC1(C)CCC(=O)C=2
|
|
MCULE-6413140986 |
0.69 |
[C@]12(C)CC[C@]3([C@@]([H])(CC=C4C[C@@H](O)CC[C@]34C)[C@]1([H])CC[C@@H]2[C@H](C)CCCC(C)C)[H]
|
|
MCULE-6069203147 |
0.69 |
C1C(C(C)CCCC(C)C)C2(C)CCC3C(CC=C4C3(C)CCC(O)C4(C)C)C2C1
|
|
MCULE-1780261202 |
0.69 |
O=C1CCC2(C)C(C1(C)C)=CCC1C2CCC2(C)C(C(C)CCCC(C)C)CCC21
|
|
MCULE-3433785012 |
0.69 |
CC(C)CC[C@@](O)([C@@](C)([C@]1(CC[C@@]2([C@@]1(CC[C@]1([C@]2(CC=C2[C@@]1(CC[C@](O)(C2)[H])C)[H])[H])C)[H])[H])[H])[H]
|
|
MCULE-1910237865 |
0.69 |
[C@]12(C)CCC3[C@@]([H])(CC=C4C[C@H](O)CC[C@]34C)C1CC[C@@H]2[C@H](C)CC[C@H](CC)C(C)C
|
|
MCULE-7049960827 |
0.69 |
[C@]12(C)CC[C@]3([C@@]([H])(CC=C4C[C@@H](O)CC[C@]34C)[C@]1([H])CC[C@]2([H])[C@]([H])(C)CC[C@@]([H])(CC)C(C)C)[H]
|
|
MCULE-9379846923 |
0.69 |
C[C@H](CCC[C@H]([C@@H]1[C@]2(C)[C@@]([C@]3([C@@](CC2)([H])[C@]2(C)C(C[C@H](CC2)O)=CC3)[H])([H])CC1)C)CO
|
|
MCULE-6498196947 |
0.69 |
C12C=CC1C1CC(O)C12
|
|
MCULE-1576185930 |
0.69 |
O[C@@H]1CC[C@@]2(C)C(C1)=CC[C@@H]1[C@@H]2CC[C@]2(C)[C@@H]([C@H](C)CCCC(C)C)CC[C@H]21
|
|
MCULE-1342617339 |
0.69 |
C1CC2C3CCCCC3=CC(=O)C2CC1
|
|
MCULE-9070724061 |
0.69 |
C1(C)(CCC(=C)C1(C)C)C(O)C(O)=O
|
|
MCULE-6818941701 |
0.69 |
C1(O)CC2(C)CCC(C(=C)C(=O)O)CC2C(=C)C1
|
|
MCULE-1048579708 |
0.69 |
C12(C)CCCC(C)(C)C1=CC(=O)CC2
|
|
MCULE-6114329924 |
0.69 |
[C@H]1(O)C[C@]2([H])[C@@](C)(CC[C@@](O)(C=C)C)[C@H](C)CC[C@@]2(C)C(C)=C1
|
|
MCULE-7051383473 |
0.69 |
C1(C)(C)C(=C)CCC1C(O)C(O)=O
|
|
MCULE-1130296851 |
0.69 |
[C@]12(C)CCC3[C@@]([H])(CC=C4CC(=O)CC[C@]34C)C1CC[C@@H]2[C@H](C)CC[C@@H](CC)C(C)C
|
|
MCULE-6742532196 |
0.69 |
C1(C)(CCC(=C)C1(C)C)C(=O)C(O)=O
|
|
MCULE-1089286417 |
0.69 |
C(/CCCCCCCC(OC)=O)=C/C/C=C\CCCCC
|
|
MCULE-9549317752 |
0.69 |
C12CC(C)(C)CC31C(C)CCC3C(C(O)=O)=C2
|
|
MCULE-9535038485 |
0.69 |
C(CC(=O)OCC)CCCCC/C=C\CCCCCCCC
|
|
MCULE-2524148130 |
0.69 |
C(CCCC(=O)OC)CCCCCC=CCC=CCC=CCC
|
|
MCULE-3753766880 |
0.69 |
C(CCCCCCCC=CCC=CCC=CCC)(OC)=O
|
|
MCULE-9199968322 |
0.69 |
C(CCC(=O)OCC)CCCCCCCCC=CCCCCCCCC
|
|
MCULE-9358636585 |
0.69 |
C1CC2(C)C3CCC4(C)C(C(CC/C=C(\C)/C(=O)O)C)CCC4(C)C=3C(=O)CC2C(C)(C)C1=O
|
|
MCULE-8944178238 |
0.69 |
CCCCCCCCC(C(/C=C\C(O)CCCCC(O)=O)O)O
|
|
MCULE-2950001631 |
0.69 |
C1CCCCCCC(C(O)=O)=C(C(O)=O)CC1
|
|
MCULE-8698326526 |
0.69 |
C(CCCCCCCCCC=CCC=CCCCCC)(=O)OC
|
|
MCULE-3486771028 |
0.69 |
C(CC(=O)OCC)CCCCCC=CCCCCCCCC
|
|
MCULE-7325515313 |
0.69 |
C1=CC2(C)C3CC=C4C(C(CC/C=C(\C)/C(=O)O)C)CCC4(C)C3(C)CCC2C(C)(C)C1=O
|
|
MCULE-4399438587 |
0.69 |
CCCCCC=CCC=CCCCCCCCC(=O)OC
|
|
MCULE-9968239395 |
0.69 |
CC/C=C\C/C=C\C/C=C\CCCCCCCC(=O)OC
|
|
MCULE-7420090326 |
0.69 |
C1(C(C)C2C(=O)CC(CC2=O)(C)C)C(=O)CC(CC=1O)(C)C
|
|
MCULE-7546264090 |
0.69 |
O=C(C[C@]1(C[C@]2([H])[C@]1(C=C(C2)CC)[H])CN)O
|
|
MCULE-6934036262 |
0.69 |
C1(C(CCCC(C2C(=O)CC(CC2=O)(C)C)C2C(=O)CC(CC=2O)(C)C)C2C(=O)CC(CC2=O)(C)C)C(=O)CC(CC=1O)(C)C
|
|
MCULE-3633249572 |
0.69 |
C1CC23CC(C(OC)=O)C(=O)C2(CC=CC3)CC=1
|
|
MCULE-2003683212 |
0.69 |
O=C(C[C@]1(C[C@]2([H])[C@]1(C=C(C2)CC)[H])CN)O
|
|
MCULE-7903507006 |
0.69 |
C1(C(CCC)C2C(=O)CC(CC2=O)(C)C)C(=O)CC(CC=1O)(C)C
|
|
MCULE-3077397941 |
0.69 |
C1(C(CCCC)C2C(=O)CC(CC2=O)(C)C)C(=O)CC(CC=1O)(C)C
|
|
MCULE-1643283288 |
0.69 |
C1(C(=O)CC(CC=1O)(C)C)C(C(C)C)C1C(=O)CC(CC1=O)(C)C
|
|
MCULE-2366326470 |
0.69 |
C12C3C4C(C5C1C(C(O)=O)=C(C(O)=O)C35)C2C=C4
|
|
MCULE-8322667113 |
0.69 |
C1(C(CC)C2C(=O)CC(CC2=O)(C)C)C(=O)CC(CC=1O)(C)C
|
|
MCULE-4894937500 |
0.69 |
[H]C12C=CCCC1(C)C1CC(C3(C)C(C(C)CCC(OC)=O)CCC3C1CC2)OC(C)=O
|
|
MCULE-7442709707 |
0.69 |
C(C)(=O)OC1CCC2(C)C3C=CC4(C)C(C(C)CCC(OC)=O)CCC4C3CCC2C1
|
|
MCULE-3754202975 |
0.69 |
C12C3C(C)(CCC(C)(C(O)=O)C3)CCC1(C)C1(C(C(=O)C=2)C2(C)CCC(C(C)(C)C2CC1)OC(C)=O)C
|
|
MCULE-2723569406 |
0.69 |
C1CC2(C)C3C(=O)CC4(C)C(C(CCC(=O)O)=C)CC(O)C4(C)C=3C(=O)CC2C(C)(C)C1=O
|
|
MCULE-7081720222 |
0.69 |
COC([C@H]1C2C=CC(CC2)[C@H]1C(O)=O)=O
|
|
MCULE-3238309101 |
0.69 |
C12(CCC(C(C(=O)O)C1C(=O)O)C=C2)C(=O)O
|
|
MCULE-7919759875 |
0.69 |
CC1([C@@H](O)CC[C@@]2(C)[C@H]1C[C@@H](C1[C@@]3(C)[C@]([C@@H]([C@@H](CCC(=O)O)C)CC3=O)(C)CC(=O)C=12)O)C
|
|
MCULE-6906348244 |
0.69 |
C(C)(=O)OC1CCC2(C)C([H])(C1)CC=C1C3CCC(C(C)C=CC(C)C(C)C)C3(C)CC(C21C)=O
|
|
MCULE-8472407044 |
0.69 |
CC1(C(=O)CC[C@@]2(C)[C@H]1C[C@@H](C1[C@@]3(C)[C@]([C@@H]([C@@H](CCC(=O)O)C)CC3=O)(C)CC(=O)C=12)O)C
|
|
MCULE-5668746450 |
0.69 |
C(=CCCCC)CCCCCCCCCC=O
|
|
MCULE-4623064101 |
0.69 |
CCCCCCCCC=CCCCCCCCCCCCCO
|
|
MCULE-2742423586 |
0.69 |
O=C1CCCCCCCC=CCCCCCCC1
|
|
MCULE-9564685678 |
0.69 |
C(CCCCCCCC=CCCCCCCCC)(CCCCCCCC=CCCCCCCCC)=O
|
|
MCULE-6860357182 |
0.69 |
C(CC)=CCCCCCCCCCCO
|
|
MCULE-1916450603 |
0.69 |
C(CCCCCCCCO)=CCCCCCCCCO
|
|
MCULE-5459783064 |
0.69 |
C(CCCCCCCO)=CCCCCCCCO
|
|
MCULE-1243509764 |
0.69 |
C/C(/C)=C/CCC1C(=O)CCCC1
|
|
MCULE-1321155051 |
0.69 |
CCCCCCCC/C=C\CCCCCCCCO
|
|
MCULE-1988512755 |
0.69 |
C/C(/C)=C/CCC1C(O)(C)CCCC1
|
|
MCULE-7776107404 |
0.69 |
C(CO)CCCCCCC=CCCCCCCCC
|
|
MCULE-3492445798 |
0.69 |
C/C(/C)=C/CCC1C(O)CCCC1
|
|
MCULE-4533311081 |
0.69 |
CC1CC(CC/C=C(\C)/C)C(=O)CC1
|
|
MCULE-6675572295 |
0.69 |
C/C(/C)=C/CC[C@H]1[C@@](O)(C)CCCC1
|
|
MCULE-3634019791 |
0.69 |
CC1CC(CC/C=C(\C)/C)C(O)CC1
|
|
MolPort-006-114-411 |
0.69 |
CCCCCC=CCC=CCCCCCCCC(=O)OC
|
|
MolPort-039-063-536 |
0.69 |
CCC(O)C(O)C\C=C/C\C=C/CCCCCCCC(O)=O
|
|
MolPort-042-675-448 |
0.69 |
CC(CC\C=C(/C)C(O)=O)C1CCC2(C)C1=CCC1C2(C)CCC2C(C)(C)C(=O)C=CC12C
|
|
MolPort-044-561-066 |
0.69 |
OC(=O)CCCCCCC\C=C/C\C=C/CCCC#C
|
|
MolPort-005-944-580 |
0.69 |
CC1CCC2C(=CC3CC(C)(C)CC123)C(O)=O
|
|
MolPort-044-183-401 |
0.69 |
CC\C=C/C\C=C/C\C=C/CCCCCCCCCC(=O)OC
|
|
MolPort-005-945-320 |
0.69 |
CCCCCCCCC(O)C(O)\C=C/C(O)CCCCC(O)=O
|
|
MolPort-009-018-990 |
0.69 |
CC\C=C/C\C=C/C\C=C/C\C=C/CCCCCCC(=O)OC
|
|
MolPort-006-130-881 |
0.69 |
CCCCCC\C=C/CCCCCCCC(=O)OCC
|
|
MolPort-039-338-083 |
0.69 |
C[C@H](CC\C=C(/C)C(O)=O)[C@H]1CC[C@@]2(C)C3=C(CC[C@]12C)[C@@]1(C)CCC(=O)C(C)(C)C1CC3=O
|
|
MolPort-046-153-169 |
0.69 |
CC(CC\C=C(/C)C(O)=O)C1CCC2(C)C3=C(CCC12C)C1(C)CCC(=O)C(C)(C)C1CC3=O
|
|
MolPort-001-785-547 |
0.69 |
CCCCC\C=C/C\C=C/CCCCCCCC(=O)OC
|
|
MolPort-046-153-126 |
0.69 |
CCCCC[C@H](O)[C@@H](O)\C=C\[C@@H](O)CCCCCCCC(O)=O
|
|
MolPort-003-927-109 |
0.69 |
CC\C=C/C\C=C/C\C=C/C\C=C/C\C=C/CCCCCC(=O)OC
|
|
MolPort-003-927-110 |
0.69 |
CCCCC\C=C/C\C=C/CCCCCCCCCC(=O)OC
|
|
MolPort-002-549-690 |
0.69 |
[Cu++].CCC(=O)C1=C([O-])CCCC1=O.CCC(=O)C1=C([O-])CCCC1=O
|
|
MolPort-003-937-572 |
0.69 |
CC\C=C/C\C=C/C\C=C/CCCCCCCC(=O)OC
|
|
MolPort-003-937-816 |
0.69 |
CCCCC\C=C\C\C=C\CCCCCCCC(=O)OC
|
|
MolPort-003-941-067 |
0.69 |
CCCCC\C=C/C\C=C/CCCCCCCCCCCC(=O)OC
|
|
MolPort-003-941-061 |
0.69 |
CC\C=C/C\C=C/C\C=C/CCCCCCCCCCCC(=O)OC
|
|
MolPort-046-677-777 |
0.69 |
OC(=O)C1=CC2CC\C=C/CCC12
|
|
MolPort-003-941-189 |
0.69 |
CC\C=C\C\C=C\C\C=C\CCCCCCCCCC(=O)OC
|
|
MolPort-003-941-323 |
0.69 |
CCCCC\C=C\C\C=C\CCCCCCCCCC(=O)OC
|
|
MolPort-046-677-788 |
0.69 |
OC(=O)C1=CC2CCCCCC12
|
|
MolPort-001-788-276 |
0.69 |
CCCCCCCC\C=C/CCCCCCCC(=O)OCC
|
|
MolPort-003-925-090 |
0.69 |
CCCCC\C=C/C\C=C/C\C=C/CCCCCCC(=O)OC
|
|
MolPort-044-183-226 |
0.69 |
CCCCCC(=O)\C=C\[C@@H]1[C@@H](C\C=C/CCCC(O)=O)[C@@H](O)CC1=C
|
|
MolPort-009-015-247 |
0.69 |
CCCCC(C1C(=O)CC(C)(C)CC1=O)C1=C(O)CC(C)(C)CC1=O
|
|
MolPort-028-754-123 |
0.69 |
CCCCCCCCCCCCCCCC(=O)O[C@H]1CC[C@@]2(C)[C@@H](CC[C@]3(C)[C@@H]2CC=C2[C@@H]4CC(C)(C)CC[C@]4(C)CC[C@@]32C)C1(C)C
|
|
MolPort-046-158-402 |
0.69 |
CC(=C)[C@@H]1CC[C@@]2(C)[C@H](O)CC(=O)C(C)=C2C1
|
|
MolPort-001-011-949 |
0.69 |
CCC(C1C(=O)CC(C)(C)CC1=O)C1=C(O)CC(C)(C)CC1=O
|
|
MolPort-002-130-411 |
0.69 |
CC(C1C(=O)CC(C)(C)CC1=O)C1=C(O)CC(C)(C)CC1=O
|
|
MolPort-001-995-568 |
0.69 |
CC1(C)CC(=O)C(CC2=C(O)CC(C)(C)CC2=O)C(=O)C1
|
|
MolPort-035-706-457 |
0.69 |
CCCCCCCCCCCCCCCC(=O)O[C@H]1CC[C@@]2(C)[C@@H](CC[C@]3(C)[C@@H]2CC=C2[C@@H]4[C@@H](C)[C@H](C)CC[C@]4(C)CC[C@@]32C)C1(C)C
|
|
MolPort-044-727-746 |
0.69 |
CCC1=C[C@@H]2[C@@H](C[C@]2(CN)CC(O)=O)C1
|
|
MolPort-046-153-147 |
0.69 |
CC12CC(=O)C3=C(C(=O)CC4C(C)(C)C(=O)CCC34C)C1(C)C(O)CC2C(=C)CCC(O)=O
|
|
MolPort-044-600-547 |
0.69 |
COC(=O)[C@H]1C2CCC(C=C2)[C@H]1C(O)=O
|
|
MolPort-002-169-466 |
0.69 |
CC(=O)OC1CCC2(C)C(CCC3(C)C2C(=O)C=C2C4CC(C)(CCC4(C)CCC32C)C(O)=O)C1(C)C
|
|
MolPort-044-650-184 |
0.69 |
OC(=O)C1C2CCC(C=C2)(C1C(O)=O)C(O)=O
|
|
MolPort-039-339-169 |
0.69 |
C[C@H](CCC(O)=O)[C@H]1CC(=O)[C@@]2(C)C3=C(C(=O)C[C@]12C)[C@@]1(C)CCC(=O)C(C)(C)[C@@H]1C[C@@H]3O
|
|
MolPort-030-082-369 |
0.69 |
CC(=O)O[C@H]1CC[C@@]2(C)C(CC[C@]3(C)C2C(=O)C=C2[C@@H]4C[C@](C)(CC[C@]4(C)CC[C@@]32C)C(O)=O)C1(C)C
|
|
MolPort-002-525-526 |
0.69 |
CC(=O)O[C@H]1CC[C@@]2(C)C(CC[C@]3(C)C2C(=O)C=C2[C@H]4C[C@](C)(CC[C@]4(C)CC[C@@]32C)C(O)=O)C1(C)C
|
|
MolPort-002-524-866 |
0.69 |
COC(=O)[C@@]1(C)CC[C@]2(C)CC[C@]3(C)C(=CC(=O)C4[C@@]5(C)CC[C@H](OC(C)=O)C(C)(C)C5CC[C@@]34C)[C@H]2C1
|
|
MolPort-003-721-217 |
0.69 |
CCCC\C=C\CCCCCCO
|
|
MolPort-006-133-633 |
0.69 |
CCCCCC\C=C/CCCCCC=O
|
|
MolPort-003-987-053 |
0.69 |
CCCCCCCC\C=C/CCCCCCCCCCCCO
|
|
MolPort-022-880-989 |
0.69 |
O=C1CCCCCCC\C=C/CCCCCCC1
|
|
MolPort-002-511-086 |
0.69 |
CC\C=C\CCCCCCCCCCO
|
|
MolPort-046-589-846 |
0.69 |
CCCCCCCC\C=C/CCCCO
|
|
MolPort-046-589-793 |
0.69 |
CCCC\C=C/CCCCCCCCCCCCO
|
|
MolPort-006-131-526 |
0.69 |
CCCC\C=C/CCCCCCCCCCCC=O
|
|
MolPort-003-930-815 |
0.69 |
OC(=O)CCCCC=C
|
|
MolPort-003-931-111 |
0.69 |
CCCCCCCC\C=C/CCCCCCCCO
|
|
MolPort-046-792-964 |
0.69 |
CCCCCCCCCC\C=C/CCCCCCCCO
|
|
MolPort-003-928-545 |
0.69 |
CCCC\C=C/CCCCCCCCCC=O
|
|
MolPort-006-131-022 |
0.69 |
CCCC\C=C/CCCCCCCCCCO
|
|
MolPort-006-128-344 |
0.69 |
CCC\C=C/CCCCCCCO
|
|
MolPort-003-959-163 |
0.69 |
CCCCCC\C=C/CCCCCCCCO
|
|
MolPort-000-422-027 |
0.68 |
CC1(C)C2CCC(C2)(C([O-])=O)C1=C
|
|
MolPort-035-706-387 |
0.68 |
CC1(C)C[C@@H](O)[C@]2(C)CC[C@]3(C)C(=CC[C@@H]4[C@@]5(C)CC[C@H](O)[C@](C)(CO)[C@@H]5CC[C@@]34C)[C@@H]2C1
|
|
MolPort-028-949-482 |
0.68 |
[Na+].OC(CCCC=C)CCCC([O-])=O
|
|
MolPort-001-740-814 |
0.68 |
C[C@]12CC[C@@H](O)C(=C)C1C[C@@H](CC2)C(=C)C(O)=O
|
|
MolPort-000-421-911 |
0.68 |
CC1(C)C2CCC(C2)(C(O)=O)C1=C
|
|
MolPort-001-739-625 |
0.68 |
CC1=CC[C@H]2C(C)(C)CCC[C@]2(C)[C@H]1CO
|
|
MolPort-001-942-587 |
0.68 |
CC1CC2=C(CC1(CO)CO)C(C)(C)CCC2
|
|
MolPort-035-706-202 |
0.68 |
CC(C)[C@]1(O)CC[C@@H](C)[C@@H]2CCC(C)=C[C@H]12
|
|
MolPort-001-816-845 |
0.68 |
O=C1CCCCC1C1=CCCCC1
|
|
MolPort-000-714-524 |
0.68 |
CC1CC(C)=CC(C)C1(CO)CO
|
|
MolPort-039-052-624 |
0.68 |
CC(=C)[C@@H](O)CC[C@](C)(O)[C@H]1CC[C@]2(C)[C@@H]1CC[C@@H]1[C@@]3(C)CCC(=O)C(C)(C)[C@@H]3CC[C@@]21C
|
|
MolPort-035-706-465 |
0.68 |
C[C@@H]1C[C@H](O)[C@]2(C)[C@@H](O)C[C@]3(C)C(=CC[C@@H]4[C@@]5(C)CC[C@H](O)C(C)(C)[C@@H]5CC[C@@]34C)[C@@H]2[C@H]1C
|
|
MolPort-002-506-918 |
0.68 |
CC1C=C(C)CCC1(CO)CO
|
|
MolPort-039-052-535 |
0.68 |
CC1(C)[C@@H](O)CC[C@]2(C)[C@H]3CC[C@](C)(C=C)C=C3CC[C@@H]12
|
|
MolPort-039-052-495 |
0.68 |
CC(C)(O)[C@H](O)CCC(=C)[C@H]1CC[C@]2(C)[C@@H]1CC[C@@H]1[C@@]3(C)CCC(=O)C(C)(C)[C@@H]3CC[C@@]21C
|
|
MolPort-021-804-489 |
0.68 |
CC12CCC(O)C(=C)C1CC(CC2)C(=C)C(O)=O
|
|
MolPort-046-149-617 |
0.68 |
O=C1CC2C=CCCC12
|
|
MolPort-046-156-410 |
0.68 |
CC(C)[C@H](C)CC[C@@H](C)[C@H]1CCC2=C3CC[C@H]4C(=C)[C@@H](O)CC[C@]4(C)[C@H]3CC[C@]12C
|
|
MolPort-046-158-394 |
0.68 |
CC(=C)[C@@H]1CC[C@]2(C)CC[C@]3(C)[C@H](CC[C@@H]4[C@@]5(C)CC[C@@H](O)[C@@](C)([C@@H]5CC[C@@]34C)C(O)=O)[C@@H]12
|
|
MolPort-046-509-060 |
0.68 |
CC1(C)CC[C@]2(CO)[C@@H](O)C[C@]3(C)C(=CC[C@@H]4[C@@]5(C)CC[C@H](O)[C@@](C)(CO)[C@@H]5CC[C@@]34C)[C@@H]2C1
|
|
MolPort-046-588-886 |
0.68 |
O=CC1(CCCCC1)C1=CCCCC1
|
|
MolPort-002-510-076 |
0.68 |
CC1C=C(C)CC[C@@]1(C)C(O)CC=C
|
|
MolPort-002-507-656 |
0.68 |
OC1CCCCC1C1=CCCCC1
|
|
MolPort-035-882-175 |
0.68 |
CC(C)[C@H](C)CC[C@@H](C)[C@H]1CC[C@H]2[C@@H]3CCC4CC(O)=CC[C@]4(C)[C@H]3CC[C@]12C
|
|
MolPort-035-706-217 |
0.68 |
C[C@]12CCCC(=C)[C@@H]1C[C@@H](CC2)C(=C)C(O)=O
|
|
MolPort-046-158-419 |
0.68 |
C[C@@]12CCC[C@](C)([C@H]1CC[C@@]13C[C@@H](C[C@H](O)[C@@H]21)C(=C)C3=O)C(O)=O
|
|
MolPort-038-820-390 |
0.68 |
COC(=O)C1CCC(=C)CC1
|
|
MolPort-001-741-862 |
0.68 |
CC1CCC2C(C)(CCC(O)C2(C)C=O)C1CC\C(C)=C/C(O)=O
|
|
MolPort-019-937-181 |
0.68 |
CC1CCC2C(=CC(=O)CC2(C)C)C1(C)CC\C(C)=C/C(O)=O
|
|
MolPort-021-804-487 |
0.68 |
CCCCC\C=C/CC(C(O)CC(O)=O)C(O)=O
|
|
MolPort-029-942-945 |
0.68 |
C\C(CCC1C(=C)CCC2C1(C)CCCC2(C)C(O)=O)=C/C(O)=O
|
|
MolPort-046-153-143 |
0.68 |
CC(C)[C@H]1CC[C@]2(C)C([C@H]1C(C=O)=C2C)C(O)=O
|
|
MolPort-006-668-275 |
0.68 |
CC(C)[C@](C)(O)C[C@@H](O)[C@](C)(O)C1CC[C@@]2(O)C3=CC(=O)C4C[C@@H](O)[C@@H](O)C[C@]4(C)C3CC[C@]12C
|
|
MolPort-039-338-335 |
0.68 |
C[C@@]12CC[C@H]3C(=CC[C@H]4C(C)(C)C(=O)CC[C@]34C)[C@@]1(C)CC[C@H]2[C@H]1COC(=O)C1
|
|
MolPort-002-513-811 |
0.68 |
COC(=O)[C@]1(C)CCC[C@@]2(C)C1CC[C@]13C=C(C(C)C)C(CC21)C1C3C(=O)C=CC1=O
|
|
MolPort-046-153-808 |
0.68 |
C[C@]12CC[C@H]3C(=CC(=O)[C@@H]4C[C@@H](O)[C@@H](O)C[C@]34C)[C@]1(O)CCC2=O
|
|
MolPort-002-510-459 |
0.68 |
CCOC(=O)CCC(C)C1CCC2C3CCC4=CC(=O)CC[C@]4(C)C3CC[C@]12C
|
|
MolPort-046-596-375 |
0.68 |
C[C@]12CC=C3C(CCC4=CC(=O)CC[C@]34C)C1CC[C@]2(O)C(=O)CO
|
|
MolPort-002-841-866 |
0.68 |
CC(=O)OC1CCC2C3C=CC4C(C)(C)C(=O)CCC4(C)C3CCC12C
|
|
MolPort-002-509-430 |
0.68 |
CCOC(=O)CC[C@H](C)[C@@H]1CCC2C3CCC4=CC(O)CC[C@]4(C)C3CC[C@]12C
|
|
MolPort-002-508-612 |
0.68 |
C[C@]12CC=C3[C@@H](CCC4=CC(=O)CC[C@]34C)C1CC[C@]2(O)C(=O)CO
|
|
MolPort-002-354-428 |
0.68 |
CC(=O)C1(O)CCC2C3C=CC4=CC(=O)CCC4(C)C3CCC12C
|
|
MolPort-044-649-594 |
0.68 |
COC(=O)[C@]12CC[C@@H](C)[C@H](C)[C@H]1C1=CC(=O)[C@@H]3[C@@]4(C)CCC(=O)C(C)(C)[C@@H]4CC[C@@]3(C)[C@]1(C)CC2
|
|
MolPort-001-741-653 |
0.68 |
CC(C)(O)CC(O)CC(C)(O)C1CCC2(O)C3=CC(=O)C4CC(O)C(O)CC4(C)C3CCC12C
|
|
MolPort-028-610-018 |
0.68 |
CC1C=CC2CCC(=O)CC22C1C(=O)C(C)=C(O)C2=O
|
|
MolPort-046-765-400 |
0.68 |
C[C@]12CC[C@@H]3[C@@H](CCC4=CC(=O)CC[C@]34C(O)=O)[C@H]1CCC2=O
|
|
MolPort-019-999-009 |
0.68 |
CC(=O)[C@@]1(O)CC[C@H]2[C@@H]3C=C(C)C4=CC(=O)CC[C@@H]4[C@H]3CC[C@]12C
|
|
MolPort-046-766-296 |
0.68 |
C[C@]12CC[C@H]3[C@@H](CCC4=CC(=O)C(CO)C[C@]34C)[C@@H]1CC[C@@]2(O)C#C
|
|
MolPort-006-167-524 |
0.68 |
CC(=O)[C@@]1(O)CC[C@H]2[C@@H]3C=C(C)C4=CC(=O)CC[C@]4(C)[C@H]3CC[C@]12C
|
|
MolPort-000-208-077 |
0.68 |
CC(=O)[C@@]1(O)CCC2C3C=CC4=CC(=O)CC[C@]4(C)C3CC[C@]12C
|
|
MolPort-001-739-246 |
0.68 |
CC1=CC(=O)[C@H]2C(C)(C)CCC[C@]2(C)[C@@]1(O)CO
|
|
MolPort-021-804-579 |
0.68 |
CC(C)(O)C(O)C[C@@H](O)[C@](C)(O)[C@H]1CC[C@@]2(O)C3=CC(=O)[C@@H]4C[C@@H](O)[C@@H](O)C[C@]4(C)C3CC[C@]12C
|
|
MCULE-1242105368 |
0.68 |
C1C[C@@]2([H])[C@H](C)CC[C@@](O)(C(C)C)[C@@]2([H])C=C1C
|
|
MCULE-2526639251 |
0.68 |
[C@]1(C)(C(CC=C)O)CCC(=CC1C)C
|
|
MCULE-6148148354 |
0.68 |
C1(C)C(C(O)C2(CO)C(C)CC=CC2)CC=CC1
|
|
MCULE-7419704729 |
0.68 |
C123C=CC1(CCC(O)C2)CCCC3
|
|
MCULE-3524678284 |
0.68 |
C1C[C@@]2(CC[C@@H](C(C(=O)O)=C)CC2C([C@@H]1O)=C)C
|
|
MCULE-9605736984 |
0.68 |
C1CC23C=CC2(CCCC3)CC1=O
|
|
MCULE-5589267581 |
0.68 |
C1CC2(C)CCC(C(=C)C(=O)O)CC2C(=C)C1O
|
|
MCULE-5216294937 |
0.68 |
O=C1C(C2CCCCC=2)CCCC1
|
|
MCULE-3038839535 |
0.68 |
C12C(C)(C)CCCC=1CC(C)C(CO)(CO)C2
|
|
MCULE-6002311928 |
0.68 |
C[C@@H]([C@@H]1[C@]2(C)C(=C3[C@H](CC2)[C@]2(C)[C@H](C([C@@H](O)CC2)=C)CC3)CC1)CC[C@H](C(C)C)C
|
|
MCULE-3790245367 |
0.68 |
C1(CO)(CO)C(C)CC(=CC1C)C
|
|
MCULE-2876144776 |
0.68 |
C12(CCC(C(C)(C)C1=C)C2)C(O)=O
|
|
MCULE-9440786663 |
0.68 |
O=C1C(=CO)CC2(C)C(C1)(CC=C1C3CCC(C(C)C=CC(C)C(C)C)C3(C)CCC21)[H]
|
|
MCULE-4677342716 |
0.68 |
O=C1C(=CO)CC2(C)C(C1)(CC=C1C3CCC(C(C)CCC(C)C(C)C)C3(C)CCC21)[H]
|
|
MCULE-7851674073 |
0.68 |
C1(=C)C2CCCC1CC(C(OC)=O)C2
|
|
MCULE-4202565953 |
0.68 |
C1CC2(C(CCC(C2CC/C(/C)=C/C(=O)O)=C)C(C(O)=O)(C)C1)C
|
|
MCULE-9205570843 |
0.68 |
C(O)(CC(=O)O)C(C/C=C\CCCCC)C(=O)O
|
|
MCULE-8575606113 |
0.68 |
C1(=O)C=C2C(C)(CC/C(/C)=C\C(=O)O)C(C)CCC2C(C)(C)C1
|
|
MCULE-5222768441 |
0.68 |
CC(C1(C(O)=O)CC=CCC1)CC#N
|
|
MCULE-7223116058 |
0.68 |
CC(C#N)(CC1(C(O)=O)CC=CCC1)C
|
|
MCULE-7375016319 |
0.68 |
[C@H]12C(C=O)=C(C)[C@](C)(CC[C@@H]1C(C)C)C2C(O)=O
|
|
MCULE-9060371972 |
0.68 |
C12CC[C@H](O)[C@@]1(C)CCC(=O)C=2
|
|
MCULE-8437877954 |
0.68 |
CC(C#N)CC1(C(O)=O)CC=CCC1
|
|
MCULE-2039968402 |
0.68 |
C12(C)CCC(C(C)(C)C1C=CC1C3C(C)(C(CC3)OC(C)=O)CCC21)=O
|
|
MCULE-7110535304 |
0.68 |
C(O)(C)(CC(O)CC(O)(C)C)C1C2(C(C3C(C4(C(CC(C(C4)O)O)C(=O)C=3)C)CC2)(O)CC1)C
|
|
MCULE-6144873686 |
0.68 |
C12=CC(=O)[C@]3([H])C[C@@H](O)[C@@H](O)C[C@]3(C)[C@@]1([H])CC[C@]1(C)C(CC[C@@]21O)=O
|
|
MCULE-8464956672 |
0.68 |
[C@]12(C)CCC3C(CCC4=CC(=O)CC[C@]34C)C1CCC2C(C)CCC(OCC)=O
|
|
MCULE-6566332427 |
0.68 |
C12=CC[C@]3(C(CC[C@]3(O)C(CO)=O)[C@]1([H])CCC1=CC(=O)CC[C@]21C)C
|
|
MCULE-3987885076 |
0.68 |
C12=CC[C@]3([C@@H](CC[C@]3(O)C(CO)=O)[C@]1([H])CCC1=CC(=O)CC[C@]21C)C
|
|
MCULE-8526293555 |
0.68 |
C1(=O)CCC(=O)C(C1)(C/C=C(\C)/CC/C=C(\C)/C)CC(=O)OC
|
|
MCULE-4046520863 |
0.68 |
[C@@H]1(C[C@@]2(C3CC[C@]4([C@@](CC[C@@H]4[C@@]([C@H](O)CC(O)C(O)(C)C)(C)O)(C3=CC([C@]2([H])C[C@H]1O)=O)O)C)C)O
|
|
MCULE-1844358842 |
0.68 |
[C@H]1(O)C[C@@]2(C3CC[C@]4([C@](CCC4[C@](O)(C)[C@H](O)C[C@](O)(C)C(C)C)(O)C3=CC(C2C[C@H]1O)=O)C)C
|
|
MCULE-1782460700 |
0.68 |
CC(C1(C2(C)C(C3C(CC2)C2(C)C(=CC(CC2)=O)C=C3)CC1)O)=O
|
|
MCULE-1537420527 |
0.68 |
[C@]12(C)CCC3C(CCC4=CC(O)CC[C@]34C)C1CC[C@H]2[C@@H](C)CCC(OCC)=O
|
|
MCULE-8239765173 |
0.68 |
[C@]12(C)CCC3C(C=CC4=CC(=O)CC[C@]34C)C1CC[C@]2(O)C(C)=O
|
|
MCULE-5208181398 |
0.68 |
C1(C(=C(O)C(=O)C23C1C(C)C=CC2CCC(=O)C3)C)=O
|
|
MCULE-1285320299 |
0.68 |
[C@@]12(C)CCC[C@@](C)(CO)C1CC[C@@]13C[C@](C=C1)(C)CCC32
|
|
MCULE-5534930691 |
0.68 |
C1CC(CCC=1C)C=O
|
|
MCULE-8211700424 |
0.68 |
C(O)(=O)C(C)(CCCC(C)=C)C=C
|
|
MCULE-9576334626 |
0.68 |
C(C1CC(C)=CC(C)C1C)=O
|
|
MCULE-3487233745 |
0.68 |
C1(C)CC(C)C(CC=1C)C=O
|
|
MCULE-7528842962 |
0.68 |
C1(C)C[C@H](C)[C@@H](CC=1C)C=O
|
|
MCULE-7688284225 |
0.68 |
C1(C=O)(C)CCC(C)=C(C)C1
|
|
MCULE-6377131123 |
0.68 |
C1CC(CO)CCC=1C
|
|
MCULE-4392799968 |
0.68 |
C1(C=O)CCC(C)=C(C)C1
|
|
MCULE-8902385122 |
0.68 |
[C@]12(C)CCC(C=C1CC[C@]1([H])[C@]2([H])CC[C@]2([C@@]1([H])CCC2=O)C)=O
|
|
MCULE-1428417742 |
0.68 |
[C@]12(C)CC[C@]3([C@@]([H])(CCC4=CC(=O)CC[C@]34C)[C@]1([H])C[C@@H](C)[C@]2(C)C(C)=O)[H]
|
|
MCULE-9637050612 |
0.68 |
O=C1CCC2C(=C1)CCC1(C)C2CC=CC1
|
|
MCULE-8417547529 |
0.68 |
C12(C)CCC3C(CCC4=CC(=O)CCC34C)C1CCC2C(C)=O
|
|
MCULE-3386101177 |
0.68 |
[C@]12(C)CCC3[C@@]([H])(CCC4=CC(=O)CC[C@]34C)C1CC[C@@H]2[C@H](C)/C=C/C(CC)C(C)C
|
|
MCULE-6538426298 |
0.68 |
O=C1CCC2(C)C3CCC4(C)C(CCCCC(C)C)CCC4C3CCC2=C1
|
|
MCULE-9945451158 |
0.68 |
[C@]12(C)C=CC(C[C@]1(C)CCC1C2CC[C@]2(C1CC[C@@H]2O)C)(C)O
|
|
MCULE-9661302470 |
0.68 |
C12(C)CCC3C(CCC4=CC(=O)CCC34C)C1CCC2C(C)CCCC(C)C
|
|
MCULE-1284522477 |
0.68 |
C12C3C4C=CC1C(C4C(=O)C3)C(=O)C2
|
|
MCULE-8690639813 |
0.68 |
[C@]12(C)[C@H](C)CC(C=C1CC[C@@H](C(C)=C)C2)=O
|
|
MCULE-4694903563 |
0.68 |
C(CO)(O)(C1CCC2C1(C)CCC1C2CC=C2CC(O)CCC21C)[H]
|
|
MCULE-8519555544 |
0.68 |
C12(C)C(C)CC(C=C1CCC(C(C)=C)C2)=O
|
|
MCULE-7384114075 |
0.68 |
C12(C)CCC(C=C1CCC1C2CCC2(C1CCC2=O)C)=O
|
|
MCULE-3125023758 |
0.68 |
C1C[C@]2(C)[C@@]3([H])CC[C@@]4([C@@H]([C@H](C)/C=C/[C@@H](CC)C(C)C)CC[C@@]4([H])[C@]3([H])CCC2=CC1=O)C
|
|
MCULE-3132312011 |
0.68 |
O=C1C=CC2(C)C3CCC4(C)CCCC4C3CCC2(C1)[H]
|
|
MCULE-2594150628 |
0.68 |
C12[C@H](CO)C(CC=1CC1(CC2(CO)CC(C1)(C)C)C)(C)C
|
|
MCULE-5576651337 |
0.68 |
[H]C(O)(C)C1C(O)CC2C1(C)CCC1C2CC=C2CC(O)CCC21C
|
|
MCULE-3425686308 |
0.68 |
C1C[C@]2(C)[C@@]3([H])CC[C@]4(C)[C@@]([H])(C(C)=O)CC[C@@]4([H])[C@]3([H])CCC2=CC1=O
|
|
MCULE-2001524479 |
0.68 |
C[C@@]12[C@H]3CC=C4[C@H]5CC(C)(C)[C@@H](O)[C@H](O)[C@]5(CO)[C@H](O)C[C@@]4(C)[C@]3(C)CCC1[C@](CO)(C)[C@@H](O)CC2
|
|
MCULE-9185909244 |
0.68 |
C1(=O)C2C3CC(C=C3)C2C(C2C3C=CC(C3)C21)=O
|
|
MCULE-3893717167 |
0.68 |
[C@]12(C)CCC3C(CCC4=CC(=O)CC[C@]34C)C1C[C@@H](CC)C2C(C)=O
|
|
MCULE-8305655266 |
0.68 |
[C@]12(CO)CC[C@@H](CC1=CC[C@]1([H])C2CC[C@]2(C1CC[C@@H]2O)C)O
|
|
MCULE-2014220888 |
0.68 |
O=C1C=CCC2(CCC3C4CCC(C4(C)CCC3C21C)=O)[H]
|
|
MCULE-5238788396 |
0.68 |
[C@]12(C)CC[C@]3([C@@]([H])(CCC4=CC(=O)CC[C@]34C)[C@]1([H])CC[C@@H]2C(C)=O)[H]
|
|
MCULE-3394759576 |
0.68 |
C1(=O)C=C2CC[C@@H](C(=C)C)C[C@@]2(C)[C@H](C)C1
|
|
MCULE-8984962328 |
0.68 |
[H]C12CC(O)C=CC1(C)C1CCC3(C)CCCC3C1CC2
|
|
MCULE-8841120984 |
0.68 |
CC(CCC[C@H]([C@@H]1[C@]2(C)[C@@]([C@]3([C@@](CC2)([H])[C@]2(C)C(=CC(=O)CC2)CC3)[H])([H])CC1)C)C
|
|
MCULE-9795083418 |
0.68 |
O=C1CC[C@@]2([C@]3(CC[C@@]4(/C(=C/C)/C(=O)C[C@@]4([H])[C@]3([H])CCC2=C1)C)[H])C
|
|
MCULE-3526435182 |
0.68 |
C12(C)CCC3C(CCC4=CC(=O)CCC34C)C1CC(C)C2(C)C(C)=O
|
|
MCULE-6738536824 |
0.68 |
O=C1C(C)=C2C(CCCC2(C)CC1)=O
|
|
MCULE-4303966960 |
0.68 |
C[C@@]12[C@H]3CC[C@]4(C)C(=O)CC[C@H]4[C@@H]3CCC1=CC(=O)CC2
|
|
MCULE-4324141268 |
0.68 |
[C@]12(C)CCC3[C@@]([H])(CC(C4=CC(=O)CC[C@]34C)C)C1CC1CCCCC21C(C)=O
|
|
MCULE-7132823730 |
0.68 |
[C@]12(C)CC[C@]3([C@@]([H])(CCC4=CC(=O)CC[C@]34C)[C@]1([H])CC[C@@H]2[C@H](C)CCCC(C)C)[H]
|
|
MCULE-7380885765 |
0.68 |
O=C1CCC2(C3CCC4(C)CCCC4C3CCC2=C1)[H]
|
|
MolPort-019-922-772 |
0.68 |
CC1=C(C)CC(CC1)C=O
|
|
MolPort-002-560-310 |
0.68 |
CC1=CCC(CC1)C=O
|
|
MolPort-002-512-003 |
0.68 |
C[C@H]1CC(C)=C(C)C[C@H]1C=O
|
|
MolPort-000-725-665 |
0.68 |
CC1CC(C)=C(C)CC1C=O
|
|
MolPort-000-740-021 |
0.68 |
CC1CC(C)=CCC1C=O
|
|
MolPort-046-153-745 |
0.68 |
C[C@]12CC[C@H]([C@@H]1[C@H]1CC[C@@H]3[C@@]4(C)CC[C@H](O)C(C)(C)[C@@H]4CC[C@@]3(C)[C@]1(C)CC2)C(=C)C=O
|
|
MolPort-023-299-061 |
0.68 |
C[C@]12CC[C@H]([C@@H]1[C@H]1CC[C@@H]3[C@@]4(C)CCC(=O)C(C)(C)[C@@H]4CC[C@@]3(C)[C@]1(C)CC2)C(=C)CO
|
|
MolPort-003-721-207 |
0.68 |
CC(=O)CCC1=C(C)CCCC1(C)C
|
|
MolPort-004-831-283 |
0.68 |
CC1=CCC(CO)CC1
|
|
MolPort-001-742-411 |
0.68 |
C[C@@]12C[C@]3(CCC4[C@](C)(CO)CCC[C@@]4(C)C3CC1)C=C2
|
|
MolPort-001-793-612 |
0.68 |
CC1=C(C)CC(C)(CC1)C=O
|
|
MolPort-002-524-345 |
0.67 |
CC(C)CCC[C@@H](C)[C@H]1CCC2[C@@H]3CCC4=CC(=O)CC[C@]4(C)C3CC[C@]12C
|
|
MolPort-046-765-458 |
0.67 |
CC[C@H](\C=C\[C@@H](C)[C@@H]1CC[C@H]2[C@@H]3CCC4=CC(=O)CC[C@]4(C)[C@H]3CC[C@]12C)C(C)C
|
|
MolPort-001-785-926 |
0.67 |
CC(=O)C1CCC2C3CCC4=CC(=O)CCC4(C)C3CCC12C
|
|
MolPort-001-794-643 |
0.67 |
CC(=O)[C@H]1CC[C@H]2[C@@H]3CCC4=CC(=O)CC[C@]4(C)[C@H]3CC[C@]12C
|
|
MolPort-046-761-473 |
0.67 |
CC[C@]12CC[C@H]3[C@@H](CCC4=C[C@@H](O)CC[C@H]34)[C@@H]1CC[C@@H]2O
|
|
MolPort-035-706-382 |
0.67 |
CC(=C)[C@@H]1CC[C@]2(C)CC[C@]3(C)[C@H](CC[C@@H]4[C@@]5(C)C=CC(=O)C(C)(C)[C@@H]5CC[C@@]34C)[C@@H]12
|
|
MolPort-046-762-740 |
0.67 |
CC(C)CCC[C@H](C)[C@@H]1CC[C@@H]2[C@@H]3CC=C4C[C@@H](O)CC[C@]4(CO)[C@@H]3CC[C@]12C
|
|
MolPort-002-525-819 |
0.67 |
C[C@]12CCC3[C@@H](CC=C4C[C@@H](O)CC[C@]34CO)C1CC[C@@H]2O
|
|
MolPort-046-693-102 |
0.67 |
C[C@]12CC[C@H]3[C@@H](CCC4=C[C@@H](O)CC[C@H]34)[C@@H]1CC[C@@H]2O
|
|
MolPort-035-706-514 |
0.67 |
CC(C)[C@@H]1C[C@@H](O)[C@H]2[C@@]1(C)CC[C@@]1(C)[C@@H]3[C@@H](O)C[C@H]4C(C)(C)[C@@H](O)CC[C@]4(C)C3=CC[C@]21C
|
|
MolPort-046-690-449 |
0.67 |
C[C@]12CC[C@H]3[C@@H](CCC4=CC(=O)CC[C@]34C)[C@@H]1CCC2=C
|
|
MolPort-035-757-683 |
0.67 |
C[C@]12CC[C@H]3[C@@H](CCC4=CC(=O)CC[C@H]34)[C@@H]1CCC2=O
|
|
MolPort-046-688-566 |
0.67 |
C[C@]12CC[C@H]3[C@@H](CCC4=CC(=O)CC[C@]34C)[C@@H]1CC=C2
|
|
MolPort-002-506-935 |
0.67 |
C[C@@H]1C[C@H]2[C@@H]3CCC4=CC(=O)CC[C@]4(C)[C@H]3CC[C@]2(C)[C@@]1(C)C(C)=O
|
|
MolPort-046-764-560 |
0.67 |
CC1(O)CC[C@@H]2[C@@H]3CCC4=C[C@@H](O)CC[C@]4(C)[C@@H]3CC[C@]12C
|
|
MolPort-002-507-478 |
0.67 |
C[C@@H]1CC(=O)C=C2CC[C@H](C[C@@]12C)C(C)=C
|
|
MolPort-001-788-520 |
0.67 |
O=C1C2C3CC(C=C3)C2C(=O)C2C3CC(C=C3)C12
|
|
MolPort-002-509-205 |
0.67 |
C[C@@H]1CC2[C@@H]3CCC4=CC(=O)CC[C@]4(C)C3CC[C@]2(C)[C@H]1C(C)=O
|
|
MolPort-002-509-923 |
0.67 |
CC[C@@H]1CC2C3CCC4=CC(=O)CC[C@]4(C)C3CC[C@]2(C)C1C(C)=O
|
|
MolPort-001-740-063 |
0.67 |
CC(=O)[C@H]1CCC2[C@@H]3CCC4=CC(=O)CC[C@]4(C)C3CC[C@]12C
|
|
MolPort-046-596-417 |
0.67 |
CC1CC2C3CC4CCCCC4(C(C)=O)[C@@]3(C)CCC2[C@@]2(C)CCC(=O)C=C12
|
|
MolPort-046-596-414 |
0.67 |
C[C@]12CCC3C(CC=C4CC(O)CC[C@]34CO)C1CCC2O
|
|
MolPort-002-511-077 |
0.67 |
C[C@@H]1CC2[C@@H]3CCC4=CC(=O)CC[C@]4(C)C3CC[C@]2(C)[C@@]1(C)C(C)=O
|
|
MolPort-019-940-196 |
0.67 |
CC1CC2C3CCC4=CC(=O)CCC4(C)C3CCC2(C)C1(C)C(C)=O
|
|
MolPort-002-517-271 |
0.67 |
C[C@]12CCC3C(CCC4=CC(=O)CCC34)C1CCC2=O
|
|
MolPort-000-730-189 |
0.67 |
CC(C)CCCC(C)C1CCC2C3CCC4=CC(=O)CCC4(C)C3CCC12C
|
|
MolPort-046-793-263 |
0.67 |
C[C@]12CC[C@H]3[C@@H](CCC4=CC(=O)CC[C@]34C)[C@@H]1CC[C@@H]2C(=O)C=C1CCCCC1
|
|
MolPort-000-146-137 |
0.67 |
CC(C)CCC[C@@H](C)[C@H]1CC[C@H]2[C@@H]3CCC4=CC(=O)CC[C@]4(C)[C@H]3CC[C@]12C
|
|
MolPort-002-525-153 |
0.67 |
CC[C@H](CC[C@@H](C)[C@H]1CCC2[C@@H]3CC=C4C[C@@H](O)CC[C@]4(CO)C3CC[C@]12C)C(C)C
|
|
MolPort-023-298-999 |
0.67 |
CC[C@H](\C=C\[C@@H](C)[C@H]1CC[C@H]2[C@@H]3CCC4=CC(=O)CC[C@]4(C)[C@H]3CC[C@]12C)C(C)C
|
|
MolPort-002-801-261 |
0.67 |
C[C@]12CCC3C(CC[C@@]4(C)CC(C)(O)C=C[C@]34C)C1CC[C@@H]2O
|
|
MolPort-046-424-108 |
0.67 |
CCC(CCC(C)C1CCC2C3CC=C4CC(O)CC[C@]4(CO)C3CC[C@]12C)C(C)C
|
|
MolPort-002-527-029 |
0.67 |
CC1C[C@H]2C3CC4CCCCC4(C(C)=O)[C@@]3(C)CCC2[C@@]2(C)CCC(=O)C=C12
|
|
MolPort-046-158-542 |
0.67 |
C[C@H](O)[C@@]1(O)CC[C@H]2[C@@H]3CC=C4C[C@@H](O)CC[C@]4(C)[C@H]3CC[C@]12C
|
|
MolPort-039-338-439 |
0.67 |
C[C@@]12CCC[C@@](C)([C@H]1C[C@H](O)[C@@]13C[C@@H](CC[C@@H]21)C(=C)C3)C(O)=O
|
|
MolPort-002-800-186 |
0.67 |
CC1(C)CC2=C([C@@H]1CO)C1(CO)CC(C)(C)CC(C)(C2)C1
|
|
MolPort-003-958-950 |
0.67 |
CC(=O)[C@H]1CC[C@H]2[C@@H]3CCC4=CC(=O)CC[C@@H]4[C@H]3CC[C@]12C
|
|
MolPort-044-652-024 |
0.67 |
CC(=O)C1CC[C@H]2[C@H]3CCC4=CC(=O)CC[C@]4(C)[C@H]3CC[C@@]12C
|
|
MolPort-003-941-496 |
0.67 |
C\C=C1/C(=O)C[C@H]2[C@@H]3CCC4=CC(=O)CC[C@]4(C)[C@H]3CC[C@]12C
|
|
MolPort-044-723-460 |
0.67 |
C[C@]12CC[C@H]3[C@@H](CCC4=C[C@@H](O)CC[C@]34C)[C@@H]1CC=C2
|
|
MolPort-019-994-121 |
0.67 |
CCC12CC[C@H]3[C@@H](CCC4=CC(=O)CC[C@H]34)[C@@H]1CCC2=O
|
|
MolPort-039-052-425 |
0.67 |
CC[C@H](CC[C@@H](C)[C@H]1CC[C@H]2[C@@H]3CCC4=CC(=O)CC[C@]4(C)[C@H]3CC[C@]12C)C(C)C
|
|
MolPort-003-892-348 |
0.67 |
CC(=O)C1=CC[C@H]2[C@@H]3CCC4=CC(=O)CC[C@]4(C)[C@H]3CC[C@]12C
|
|
MolPort-044-728-843 |
0.67 |
CC(=O)[C@@H]1CC[C@@H]2[C@H]3CCC4=CC(=O)CC[C@@]4(C)[C@@H]3CC[C@@]12C
|
|
MolPort-002-904-212 |
0.67 |
O=C1C2[C@H]3C[C@H](C=C3)C2C(=O)C2[C@H]3C[C@H](C=C3)C12
|
|
MolPort-019-990-215 |
0.67 |
CC(=O)C1=CCC2C3CCC4=CC(=O)CCC4(C)C3CCC12C
|
|
MolPort-023-274-272 |
0.67 |
CCC(\C=C\[C@@H](C)[C@H]1CCC2[C@@H]3CCC4=CC(=O)CC[C@]4(C)C3CC[C@]12C)C(C)C
|
|
MolPort-044-561-253 |
0.67 |
CC(C)CCC[C@@H](C)[C@H]1CC[C@H]2[C@@H]3CC=C4C[C@@H](O)CC[C@]4(CO)[C@H]3CC[C@]12C
|
|
MolPort-039-052-703 |
0.67 |
C[C@]1(CCC[C@]2(C)[C@@H]1CC[C@@]13C[C@H](CC[C@@]21O)C(=C)C3)C(O)=O
|
|
MolPort-003-847-259 |
0.67 |
CC[C@]12CC[C@H]3[C@@H](CCC4=CC(=O)CC[C@H]34)[C@@H]1CCC2=O
|
|
MolPort-023-276-307 |
0.67 |
CC=C1C(=O)C[C@H]2[C@@H]3CCC4=CC(=O)CC[C@]4(C)[C@H]3CC[C@]12C
|
|
MolPort-023-299-008 |
0.67 |
CC[C@H](CC[C@@H](C)[C@H]1CC[C@H]2[C@@H]3CCC4=CC(=O)CC[C@]4(C)[C@H]3CC[C@]12C)C(C)=C
|
|
MolPort-002-526-176 |
0.67 |
CC(C)[C@H](C)\C=C\[C@@H](C)[C@H]1CCC2[C@@H]3CCC4=CC(=O)CC[C@]4(C)C3CC[C@]12C
|
|
MolPort-003-849-979 |
0.67 |
[2H]C1=C2C([2H])([2H])C[C@H]3[C@@H]4CC[C@]([2H])(C(=O)C([2H])([2H])[2H])[C@@]4(C)CC[C@@H]3[C@@]2(C)CC([2H])([2H])C1=O
|
|
MolPort-046-426-158 |
0.67 |
CC1(C)C[C@H]2C3=CC[C@@H]4[C@@]5(C)CC[C@H](O)[C@@](C)(CO)[C@@H]5CC[C@@]4(C)[C@]3(C)C[C@H](O)[C@@]2(CO)[C@@H](O)[C@@H]1O
|
|
MolPort-044-561-305 |
0.67 |
CCCCC\C=C/C=C/C=C\CCCCCCC(O)=O
|
|
MolPort-004-802-886 |
0.67 |
CC1CCC(O)=CC1=O
|
|
MolPort-006-111-740 |
0.67 |
CCCC\C=C\C=C\C=C\CCCCCCCC(O)=O
|
|
MolPort-009-018-817 |
0.67 |
OC(=O)CCCCCCCC\C=C/C(O)=O
|
|
MolPort-003-927-207 |
0.67 |
OC(=O)CCCCCCCC\C=C\C(O)=O
|
|
MolPort-044-754-165 |
0.67 |
OC(=O)CCCCCCCCCCC\C=C\C(O)=O
|
|
MolPort-001-816-339 |
0.67 |
OC(=O)C(C1CCC=C1)C(O)=O
|
|
MolPort-028-610-143 |
0.67 |
OC(=O)CCCCCC\C=C\C(O)=O
|
|
MolPort-039-139-043 |
0.67 |
CCCC\C=C\C=C\C=C/CCCCCCCC(O)=O
|
|
MolPort-019-937-247 |
0.67 |
CCCCCCCCCCCCC(O)\C=C\CCC(O)=O
|
|
MolPort-044-754-166 |
0.67 |
OC(=O)CCCCCCCCC\C=C\C(O)=O
|
|
MolPort-005-945-021 |
0.67 |
CC\C=C\CC1=C(CCCCCCCC(O)=O)CCC1=O
|
|
MolPort-006-668-177 |
0.67 |
C\C(CCC1C(=C)CCC2C1(C)CC(O)CC2(C)C(O)=O)=C/C(O)=O
|
|
MolPort-046-590-621 |
0.67 |
CCOC(=O)[C@H]1[C@H]2CC\C=C/CC[C@@H]12
|
|
MolPort-042-675-446 |
0.67 |
CC(CC\C=C(/C)C(O)=O)C1CCC2(C)C1=CCC1C2(C)CCC2C(C)(C)C(O)CC(O)C12C
|
|
MolPort-006-109-342 |
0.67 |
CC\C=C/C[C@@H]1[C@@H](CC(=O)OC)CCC1=O
|
|
MolPort-001-739-551 |
0.67 |
CCCCC\C=C/C\C=C/C(O)CC(O)CCCCC(O)=O
|
|
MolPort-046-591-674 |
0.67 |
CCOC(=O)C1C2CC\C=C/CCC12
|
|
MolPort-046-153-747 |
0.67 |
C[C@H]1C[C@@H](O)[C@H](CC2=C(C)C(=O)C[C@H]12)C(C)(C)O
|
|
MolPort-046-153-152 |
0.67 |
CC(CC\C=C(/C)C(O)=O)C1CCC2(C)C3=C(C(=O)CC12C)C1(C)CCC(=O)C(C)(C)C1CC3=O
|
|
MolPort-046-646-765 |
0.67 |
OC(=O)C1=CC2CCCC12
|
|
MolPort-035-784-535 |
0.67 |
CCOC(=O)[C@@H]1[C@H]2CC\C=C/CC[C@@H]12
|
|
MolPort-001-742-388 |
0.67 |
CC1(C)CC2C1CC\C(=C/CCC2=C)C(O)=O
|
|
MolPort-023-274-334 |
0.67 |
CCCCC\C=C/C(O)C(O)C(O)CCCCCCCC(O)=O
|
|
MolPort-039-337-800 |
0.67 |
CC\C=C\CC1C(CC(=O)OC)CCC1=O
|
|
MolPort-027-640-890 |
0.67 |
OCCCCC[C@H](O)\C=C\[C@H]1[C@H](O)CC(=O)[C@@H]1C\C=C/CCCC(O)=O
|
|
MolPort-021-783-065 |
0.67 |
CCCCCC(O)\C=C\C1C(O)CC(=O)C1C\C=C\CCCC(O)=O
|
|
MolPort-027-640-889 |
0.67 |
CCCCCCC[C@H](O)\C=C\[C@H]1[C@H](O)CC(=O)[C@@H]1C\C=C/CCCC(O)=O
|
|
MolPort-027-640-882 |
0.67 |
CCCCC[C@](C)(O)\C=C\[C@H]1[C@H](O)CC(=O)[C@@H]1C\C=C/CCCC(O)=O
|
|
MolPort-027-640-881 |
0.67 |
CCCCC[C@@](C)(O)\C=C\[C@H]1[C@H](O)CC(=O)[C@@H]1C\C=C/CCCC(O)=O
|
|
MolPort-046-158-388 |
0.67 |
C[C@@H](C[C@@H](O)C1OC1(C)C)[C@@H]1CC[C@]2(C)C3=CC[C@H]4C(C)(C)C(=O)CC[C@]4(C)[C@H]3CC[C@@]12C
|
|
MolPort-027-640-880 |
0.67 |
CCCCC[C@@H](O)\C=C\[C@H]1[C@H](O)CC(=O)[C@@H]1C\C=C/CCCC(O)=O
|
|
MolPort-027-640-878 |
0.67 |
CCCCC[C@H](O)\C=C\[C@H]1[C@@H](O)CC(=O)[C@@H]1C\C=C/CCCC(O)=O
|
|
MolPort-027-640-875 |
0.67 |
CCCCC[C@H](O)\C=C\[C@H]1[C@H](O)CC(=O)[C@H]1C\C=C/CCCC(O)=O
|
|
MolPort-004-964-562 |
0.67 |
CCCCCC(=O)\C=C\[C@H]1[C@H](O)CC(=O)[C@@H]1C\C=C/CCCC(O)=O
|
|
MolPort-002-514-341 |
0.67 |
C[C@]12CCC3C(CC=C4CC(O)CC[C@]34C)C1CCC2C(=O)CC(C#N)(C#N)C(C#N)C#N
|
|
MolPort-009-018-244 |
0.67 |
CCCCC[C@@H](O)\C=C\[C@@H]1C(C\C=C/CCCC(O)=O)C(O)CC1=O
|
|
MolPort-004-964-677 |
0.67 |
CCCCCC(=O)\C=C\[C@H]1[C@H](O)C[C@H](O)[C@@H]1C\C=C/CCCC(O)=O
|
|
MolPort-044-561-509 |
0.67 |
CCCCC[C@H](O)\C=C\[C@H]1[C@H](O)CC(=O)[C@@H]1C\C=C/CCCCCC(O)=O
|
|
MolPort-005-945-123 |
0.67 |
COC(=O)\C=C(/C)CC[C@]1(C)[C@@H](C)CC[C@@]2(C)[C@H]1CCC=C2C(O)=O
|
|
MolPort-002-515-580 |
0.67 |
C[C@]12CCC3C(CCC4=CC(=O)CC[C@]34C)C1CC[C@@]21CCO1
|
|
MolPort-009-018-292 |
0.67 |
CCCCCC(O)\C=C\[C@@H]1C(C\C=C/CCCC(O)=O)C(O)CC1=O
|
|
MolPort-016-586-413 |
0.67 |
CC(C)(C)C12C=CC1(C(C)(C)C)C(C)(O)C2=O
|
|
MolPort-003-800-707 |
0.67 |
CC1(C)[C@@H](O)CC[C@@]2(C)[C@H]1CC=C(C=O)[C@@H]2C#N
|
|
MolPort-003-800-478 |
0.67 |
OC(=O)C1=C(C2C3C4CC2C1C34)C(O)=O
|
|
MolPort-027-640-941 |
0.67 |
O[C@H](\C=C\[C@H]1[C@H](O)C[C@H](O)[C@@H]1C\C=C/CCCC(O)=O)C1CCCCC1
|
|
MolPort-009-018-297 |
0.67 |
CCCCCC(O)\C=C\[C@@H]1C(C\C=C\CCCC(O)=O)C(O)CC1=O
|
|
MolPort-038-386-562 |
0.67 |
CC1(C)CCCC2(C3CCC(C)(C=C)C=C3C(=O)CC12)C(O)=O
|
|
MolPort-027-640-874 |
0.67 |
CCCCC[C@H](O)\C=C\[C@H]1[C@H](O)CC(=O)[C@@H]1C\C=C\CCCC(O)=O
|
|
MolPort-027-640-829 |
0.67 |
CCCCC[C@H](O)\C=C\[C@@H]1[C@@H](C\C=C\CCCC(O)=O)[C@@H](O)CC1=O
|
|
MolPort-009-018-304 |
0.67 |
CCCCC[C@@](C)(O)\C=C\[C@@H]1C(C\C=C/CCCC(O)=O)C(O)CC1=O
|
|
MolPort-009-018-305 |
0.67 |
CCCCC[C@](C)(O)\C=C\[C@@H]1C(C\C=C/CCCC(O)=O)C(O)CC1=O
|
|
MolPort-027-640-924 |
0.67 |
CCCCCC(=O)\C=C\[C@H]1[C@H](O)C[C@H](O)[C@H]1C\C=C/CCCC(O)=O
|
|
MolPort-039-138-890 |
0.67 |
CCCCC(C)(C)[C@H](O)\C=C\[C@@H]1[C@@H](C\C=C/CCCC(O)=O)[C@@H](O)CC1=O
|
|
MolPort-002-527-896 |
0.67 |
C[C@]12CCC3C(CCC4=CC(=O)CCC34)C1CC[C@@]21CCO1
|
|
MolPort-044-183-485 |
0.67 |
[2H]C([2H])(CC(O)=O)C([2H])([2H])\C=C/C[C@@H]1[C@@H](\C=C\[C@@H](O)CCCCC)[C@H](O)CC1=O
|
|
MolPort-023-274-403 |
0.67 |
CC(=O)C1=CCC2C3CC=C4CC(O)CC(O)C4(C)C3C(O)CC12C
|
|
MolPort-039-338-521 |
0.67 |
COC(=O)[C@]12CCC(C)(C)C[C@H]1C1=CC[C@@H]3[C@@]4(C)C[C@H](O)[C@H](O)[C@@](C)(CO)[C@@H]4CC[C@@]3(C)[C@]1(C)CC2
|
|
MolPort-044-649-737 |
0.67 |
COC(=O)[C@]12CC[C@@H](C)[C@H](C)[C@H]1C1=CC[C@@H]3[C@@]4(C)C[C@@H](O)[C@H](O)[C@@](C)(CO)[C@@H]4CC[C@@]3(C)[C@]1(C)CC2
|
|
MolPort-039-139-086 |
0.67 |
CCCCC[C@@H](O)\C=C\[C@@H]1[C@@H](O)CC(=O)[C@H]1C\C=C/CCCC(O)=O
|
|
MolPort-044-183-119 |
0.67 |
CCCCCC(=O)\C=C\[C@H]1[C@H](O)C[C@@H](O)[C@H]1C\C=C/CCCC(O)=O
|
|
MolPort-039-052-567 |
0.67 |
C[C@@H](CC(=O)[C@@H]1OC1(C)C)[C@@H]1CC[C@]2(C)C3=CC[C@H]4C(C)(C)C(=O)CC[C@]4(C)[C@H]3CC[C@@]12C
|
|
MolPort-027-640-986 |
0.67 |
CCCCC[C@H](O)\C=C\[C@@H]1[C@@H](C\C=C/CCCC(O)=O)C(=O)CC1=O
|
|
MolPort-035-706-426 |
0.67 |
C[C@@H](C[C@@H](O)[C@@H]1OC1(C)C)[C@@H]1CC[C@]2(C)C3=CC[C@H]4C(C)(C)C(=O)CC[C@]4(C)[C@H]3CC[C@@]12C
|
|
MolPort-003-939-184 |
0.67 |
CCCCC[C@H](O)\C=C\[C@H]1[C@H](O)CC(=O)[C@@H]1C\C=C/CCCC(O)=O
|
|
MolPort-044-183-256 |
0.67 |
CCCCCC(=O)\C=C\[C@H]1[C@H](O)CC(=O)[C@H]1C\C=C/CCCC(O)=O
|
|
MolPort-003-940-883 |
0.67 |
CCCCC(C)(C)[C@H](O)\C=C\[C@H]1[C@H](O)CC(=O)[C@@H]1C\C=C/CCCC(O)=O
|
|
MolPort-009-019-596 |
0.67 |
CCCCC(F)(F)[C@H](O)CC[C@@H]1[C@@H](C\C=C/CCCC(O)=O)[C@@H](O)CC1=O
|
|
MolPort-035-705-806 |
0.67 |
COC(=O)\C=C(/C)CC[C@@]1(C)[C@H](C)CC[C@]2(C)[C@@H]1CCC=C2C(O)=O
|
|
MolPort-023-221-738 |
0.67 |
CCCCCCCCCCCCCCCCCCOC(=O)[C@@]1(C)CC[C@]2(C)CC[C@]3(C)C(=CC(=O)[C@@H]4[C@@]5(C)CC[C@H](O)C(C)(C)C5CC[C@@]34C)[C@H]2C1
|
|
MolPort-035-686-140 |
0.67 |
C[C@H](CC(=O)C[C@@H](C)C(O)=O)[C@H]1C[C@H](O)[C@@]2(C)C3=C(C(=O)C[C@]12C)[C@@]1(C)CCC(=O)C(C)(C)C1C[C@@H]3O
|
|
MolPort-006-114-068 |
0.67 |
[K+].C[C@]12CC[C@H]3[C@@H](C=CC4=CC(=O)CC[C@]34C)[C@@H]1CC[C@@]2(O)CCC([O-])=O
|
|
MolPort-006-823-887 |
0.67 |
C[C@H](CC(=O)C[C@@H](C)C(O)=O)[C@H]1CC(=O)[C@@]2(C)C3=C(C(=O)C[C@]12C)[C@@]1(C)CCC(=O)C(C)(C)[C@@H]1C[C@@H]3O
|
|
MolPort-006-069-345 |
0.67 |
CC(C)C(=C)CC[C@H]([C@H]1[C@H](O)C[C@@]2(C)C3=C(CC[C@]12C)[C@@]1(C)CC[C@H](OC(C)=O)C(C)(C)[C@@H]1CC3)C(O)=O
|
|
MolPort-039-338-121 |
0.67 |
C[C@H](CC(=O)\C=C(\C)[C@H]1CC(=O)[C@@]2(C)C3=C(C(=O)C[C@]12C)[C@@]1(C)CC[C@H](O)C(C)(C)C1CC3=O)C(O)=O
|
|
MolPort-039-338-981 |
0.67 |
C[C@H](CC(=O)C[C@@H](C)C(O)=O)[C@H]1CC(=O)[C@@]2(C)C3=C(C(=O)C[C@]12C)[C@@]1(C)CCC(=O)C(C)(C)C1C[C@@H]3O
|
|
MolPort-039-338-226 |
0.67 |
C[C@]1(CCC[C@]2(C)[C@@H]1CC[C@@]13C[C@@](O)(CC=C21)C(=C)C3=O)C(O)=O
|
|
MolPort-046-153-787 |
0.67 |
C[C@H](CC(=O)C[C@@H](C)C(O)=O)[C@H]1CC(=O)[C@@]2(C)C3=C(C(=O)C[C@]12C)[C@@]1(C)CC[C@H](O)C(C)(C)C1C[C@@H]3O
|
|
MolPort-039-338-983 |
0.67 |
C[C@H](CC(=O)CC(C)C(O)=O)[C@H]1C[C@H](O)[C@@]2(C)C3=C(C(=O)C[C@]12C)[C@@]1(C)CCC(=O)C(C)(C)C1C[C@@H]3O
|
|
MolPort-039-141-999 |
0.67 |
CC(CC(=O)CC(C)C(O)=O)C1CC(O)C2(C)C3=C(C(=O)CC12C)C1(C)CCC(=O)C(C)(C)C1CC3O
|
|
MolPort-003-935-397 |
0.67 |
CCCCCCCCCCCCCCCCCCOC(=O)[C@@]1(C)CC[C@]2(C)CC[C@]3(C)C(=CC(=O)[C@@H]4[C@@]5(C)CC[C@H](O)C(C)(C)[C@@H]5CC[C@@]34C)[C@@H]2C1
|
|
MolPort-039-338-852 |
0.67 |
COC(=O)CC[C@@]1(C)[C@@H](CC[C@@H]2C1=CC[C@]1(C)[C@H](CC[C@@]21C)[C@H](C)CC\C=C(\C)C(O)=O)C(C)=C
|
|
MolPort-003-987-059 |
0.67 |
CCOC(=O)[C@]1(C)CCC[C@]2(C)[C@H]3CCC(=CC3=CC[C@@H]12)C(C)C
|
|
MolPort-039-338-190 |
0.67 |
C[C@H](CC(=O)CC(C)C(O)=O)[C@H]1CC(=O)[C@@]2(C)C3=C(C(=O)C[C@]12C)[C@@]1(C)CCC(=O)C(C)(C)C1C[C@@H]3O
|
|
MolPort-020-001-490 |
0.67 |
C[C@H](CC(=O)C[C@@H](C)C(O)=O)[C@H]1C[C@H](O)[C@@]2(C)C3=C(C(=O)C[C@]12C)[C@@]1(C)CCC(=O)C(C)(C)[C@@H]1C[C@@H]3O
|
|
MolPort-003-666-334 |
0.67 |
[K+].C[C@]12CCC3C(C=CC4=CC(=O)CC[C@]34C)C1CC[C@@]2(O)CCC([O-])=O
|
|
MolPort-044-562-376 |
0.67 |
CC(C)=CCC[C@H]([C@H]1[C@H](O)C[C@@]2(C)C3=C(CC[C@]12C)[C@@]1(C)CC[C@H](OC(C)=O)C(C)(C)C1CC3)C(O)=O
|
|
MolPort-046-594-358 |
0.67 |
CC(CC(=O)CC(C)C(O)=O)C1CC(=O)C2(C)C3=C(C(=O)CC12C)C1(C)CCC(=O)C(C)(C)C1CC3O
|
|
MolPort-039-338-126 |
0.67 |
C[C@H](C[C@H](O)\C=C(/C)C(O)=O)[C@H]1CC(=O)[C@@]2(C)C3=C(C(=O)C[C@]12C)[C@@]1(C)CCC(=O)C(C)(C)C1C[C@@H]3O
|
|
MCULE-1729412984 |
0.67 |
C(C1CCC=C1)(C(O)=O)C(O)=O
|
|
MCULE-5765051698 |
0.67 |
C(CCCC=CC(O)=O)CCCCC(O)=O
|
|
MCULE-9564533694 |
0.67 |
OC(=O)/C=C/CCCCCCCCCCCC(=O)O
|
|
MCULE-2021957290 |
0.67 |
C(C)CCCCCCCCCCC(O)/C=C/CCC(=O)O
|
|
MCULE-1261827700 |
0.67 |
OC(=O)/C=C/CCCCCCCCCC(=O)O
|
|
MCULE-7311176198 |
0.67 |
C(=O)(O)CCCCCCCC(O)C(O)C(O)/C=C\CCCCC
|
|
MCULE-2410702763 |
0.67 |
C(O)(=O)CCCCC(O)CC(/C=C\C/C=C\CCCCC)O
|
|
MCULE-9190698368 |
0.67 |
O=C(CC1CCC(=O)C1CC=CCC)OC
|
|
MCULE-3465723245 |
0.67 |
[C@@H]1(CCC(=O)[C@@H]1CC=CCC)CC(=O)OC
|
|
MCULE-4134342158 |
0.67 |
[C@@]12([H])[C@@H](C)C[C@@H](O)[C@@H](C(O)(C)C)CC1=C(C)C(=O)C2
|
|
MCULE-2519630522 |
0.67 |
C12C(CCC=C(C(O)=O)CCC1C(C)(C)C2)=C
|
|
MCULE-2422100047 |
0.67 |
C1(C/C=C/CC)=C(CCC1=O)CCCCCCCC(=O)O
|
|
MCULE-4753796367 |
0.67 |
C1(O)CC2(C(CCC(C2CC/C(/C)=C/C(=O)O)=C)C(C)(C1)C(O)=O)C
|
|
MCULE-5926783574 |
0.67 |
C1C(O)C2(C)C3CC=C4C(C(CC/C=C(\C)/C(=O)O)C)CCC4(C)C3(C)CCC2C(C)(C)C1O
|
|
MCULE-8629208814 |
0.67 |
O=CC1(CCOCC1)CC1CC=CCC1
|
|
MCULE-7117901308 |
0.67 |
C1CC2(C)C3C(=O)CC4(C)C(C(CC/C=C(\C)/C(=O)O)C)CCC4(C)C=3C(=O)CC2C(C)(C)C1=O
|
|
MCULE-2271099763 |
0.67 |
C12CC3C4C(C(O)=O)=C(C(=O)O)C3C1C24
|
|
MCULE-7277661521 |
0.67 |
C1C(O)C2(C)C3C(O)CC4(C)C(C(C)=O)=CCC4C3CC=C2CC1O
|
|
MCULE-7424984034 |
0.67 |
C1C[C@]2([H])[C@@](C)(CC/C(=C/C(OC)=O)/C)[C@H](C)CC[C@@]2(C)C(C(=O)O)=C1
|
|
MCULE-7865324905 |
0.67 |
C12CC3C(CC(O)C(O)C3)CC1(C)C=CC1=C(C)C(=O)CCC21
|
|
MCULE-6267867370 |
0.67 |
C12(C(C)(C)C)C=CC1(C(=O)C2(C)O)C(C)(C)C
|
|
MCULE-4937005028 |
0.67 |
[C@]12(C)CCC3C(CCC4=CC(=O)CCC43)C1CC[C@]12CCO1
|
|
MCULE-4791941925 |
0.67 |
[C@]12(C)CCC3C(CC=C4CC(O)CC[C@]34C)C1CCC2C(=O)CC(C(C#N)C#N)(C#N)C#N
|
|
MCULE-6190050690 |
0.67 |
C1(C=O)C(O)(C=O)C[C@@]2([C@@](CCCC2)(C)C=1)[H]
|
|
MCULE-4504889503 |
0.67 |
[C@]12(C)CC[C@H](O)C(C)(C)[C@]1([H])CC=C(C=O)[C@@H]2C#N
|
|
MCULE-8924549531 |
0.67 |
C1C[C@]2(C)C3CC[C@]4(C)[C@@]([H])([C@H](C(O)=O)CCC(=C)C(C)C)[C@H](O)C[C@@]4(C)C=3CC[C@@]2([H])C(C)(C)[C@H]1OC(C)=O
|
|
MCULE-8274191901 |
0.67 |
[C@@]12(C)C[C@H]([C@]([H])([C@H](C(=O)O)CCC(=C)C(C)C)[C@@]1(C)CCC1[C@@]3(C)CC[C@H](OC(=O)C)C(C)(C)[C@]3([H])CCC2=1)O
|
|
MCULE-5015030206 |
0.67 |
CCCCCCCCCCCCCCCCCCOC([C@]1(CC[C@@]2(C)[C@](C3=CC([C@]4([C@](CC[C@@]5([C@@]4(CC[C@](O)(C5(C)C)[H])C)[H])(C)[C@]3(C)CC2)[H])=O)(C1)[H])C)=O
|
|
MCULE-6290581989 |
0.67 |
CC(C1C2(C)CC(C3C4(C)CCC(C(C)(C)C4CC(O)C=3C2(C)C(O)C1)=O)=O)CC(CC(C(O)=O)C)=O
|
|
MCULE-7594353501 |
0.67 |
C1C[C@@]2(C)C3=CC[C@@]4(O)C(=C)C(=O)[C@@]3(C4)CC[C@]2([H])[C@](C)(C(=O)O)C1
|
|
MCULE-9246661061 |
0.67 |
C(C(=O)OC)C[C@]1(C)C2=CC[C@@]3([C@@]([H])([C@@H](CC/C=C(\C(O)=O)/C)C)CC[C@@]3(C)[C@]2([H])CC[C@@]1([H])C(=C)C)C
|
|
MCULE-9033649357 |
0.67 |
CCOC([C@@]1(CCC[C@@]2(C)[C@]1(CC=C1[C@@]2(CCC(C(C)C)=C1)[H])[H])C)=O
|
|
MCULE-6664715607 |
0.67 |
CC(C1C2(C)CC(C3C4(C)CCC(C(C)(C)C4CC(O)C=3C2(C)C(=O)C1)=O)=O)CC(CC(C(O)=O)C)=O
|
|
MCULE-1789440443 |
0.67 |
O=C(O)C1C(N)C2CCC1C=C2
|
|
MCULE-5243784193 |
0.67 |
C(OCCCCCCCCCCCCCCCCCC)(=O)[C@@]1(C[C@@]2(C3=CC([C@]4([H])[C@]5(C)C(CC[C@]4([C@@]3(CC[C@]2(CC1)C)C)C)C(C)(C)[C@H](CC5)O)=O)[H])C
|
|
MCULE-7772727437 |
0.67 |
C(C)(=O)OC1CCC2(C)C(C1)(CCC1C3CCC(C(C)C=CC(C)C(C)C)C3(C)CC(C2=1)=O)[H]
|
|
MCULE-2740918613 |
0.67 |
CC1([C@@]2([H])[C@](C3C(=O)C[C@@]4(C)[C@@](C)([C@H](C[C@@H]4[C@@H](CC(=O)C[C@H](C(=O)O)C)C)O)C=3[C@H](C2)O)(C)CCC1=O)C
|
|
MCULE-8267556474 |
0.67 |
C12C3C(C)(CCC(C)(C3)C(=O)OC3CCCCC3C)CCC1(C)C1(C(C(=O)C=2)C2(C)CCC(C(C)(C)C2CC1)OC(C)=O)C
|
|
MCULE-6630966108 |
0.67 |
O[C@H]1C[C@H]2C(C)(C)C(CC[C@]2(C)C2C(C[C@]3(C)[C@@H]([C@H](C)CC(C[C@H](C(=O)O)C)=O)CC([C@@]3(C)C=21)=O)=O)=O
|
|
MCULE-7356333105 |
0.67 |
C([C@H]1CCC(=O)[C@@H]1CCCCCCC(OC)=O)=C[C@H](CCCCC)O
|
|
MCULE-1081447415 |
0.67 |
O=C1C=C2CC(OC)CCC2(C)C2CCC3(C)C(C(C)CCCC(C)C)CCC3C21
|
|
MCULE-7890127494 |
0.67 |
C12CCC(=O)C(C)=C1C=CC1CC(O)C(O)CC21
|
|
MCULE-3020807810 |
0.67 |
C1=CC2CC1C(C2)C=O
|
|
MCULE-7244926496 |
0.67 |
CCC(C1(C(O)=O)CC=CCC1)C#N
|
|
MCULE-7174333293 |
0.67 |
C1C(C[C@@H](CC=1C)CCC)=O
|
|
MCULE-2517844980 |
0.67 |
O=C(CCCCCC[C@H]1C(=O)C[C@@H](O)[C@@H]1/C=C/[C@H](CCCCC)O)O
|
|
MCULE-9551990259 |
0.67 |
CC1=CC(=O)CC(CC)C1
|
|
MCULE-2990920571 |
0.67 |
CC1(C(CC2CC=CC2)=O)CCCCC1
|
|
MCULE-9427917092 |
0.67 |
C1(CCC=C(C)C)CC(C)C(CC=1)C=O
|
|
MCULE-1919718019 |
0.67 |
C1CC2CCC=C2C(C)(C)C1=O
|
|
MCULE-7591578797 |
0.67 |
[C@H]1(CCCCCCC(=O)O)C(=O)C[C@@H](O)[C@@H]1C=C[C@@H](O)CCCCC
|
|
MCULE-7323379876 |
0.67 |
C1C2(CO)CCC2(CO)CC=C1
|
|
MCULE-2979260832 |
0.67 |
C1CC2(CO)CCCC2(CO)CC=1
|
|
MCULE-2126006986 |
0.67 |
C1(C)(C(C)=O)CC=C(CC1C)CC/C=C(\C)/C
|
|
MCULE-6005158959 |
0.67 |
CC1CC(CC2CC=CC2)(O)CCC1
|
|
MCULE-7590026618 |
0.67 |
CC1C(CC2CC=CC2)(O)CCCC1
|
|
MCULE-4162330770 |
0.67 |
C1CC2=CC(=O)C(C(=C)C)CC2(CO)C(C)C1O
|
|
MCULE-1025553559 |
0.67 |
C(C1=CCCC2(CCCCC2)C1)O
|
|
MCULE-8275719671 |
0.67 |
C1CC(C)(CCC=1CC/C=C(\C)/C)C=O
|
|
MCULE-5918636692 |
0.67 |
C1(=O)[C@H](CCCCCCC(=O)O)[C@@H](C=C[C@@H](O)CCCCC)[C@H](O)C1
|
|
MCULE-7495390356 |
0.67 |
C1(=O)C(CCCC1C1CCCCC=1)CC1CCCC(C2CCCCC=2)C1=O
|
|
MCULE-7065925222 |
0.67 |
C[C@]12CC=C3[C@](CCC4[C@]3(C)C=CC(=O)C=4)([H])[C@]1([H])C[C@@H](C)[C@]2(O)C(=O)CO
|
|
MCULE-9861301536 |
0.67 |
C1C(CC(CC=1C)CCC)=O
|
|
MCULE-8616711102 |
0.67 |
C1C[C@]2(C)[C@@]3([H])CC[C@@](C=C)(C)C=C3CC[C@@]2([H])[C@](C)(CO)[C@H]1O
|
|
MCULE-7502094563 |
0.67 |
OC1(CCCCC1)CC1CC=CC1
|
|
MCULE-9073699986 |
0.67 |
[C@]12([H])[C@](CO)(C)C=C(CO)[C@]1(C)[C@@]1([H])CC=C3[C@]4([H])[C@@](O)(C)[C@H](C)CC[C@]4(C(=O)O)CC[C@@]3(C)[C@]1(C)CC2
|
|
MCULE-6471729935 |
0.67 |
C1CC2[C@@]3([H])CC[C@]4(C)[C@@](C#C)(O)CC[C@@]4([H])[C@]3([H])[C@H](C)CC=2CC1=O
|
|
MCULE-9554247289 |
0.67 |
C1CC2(CO)CC(C)(C)CC2(CO)CC=1
|
|
MCULE-9003092096 |
0.67 |
[Na+].C12(CCC(C(C)(C)C1=C)C2)C(=O)[O-]
|
|
MCULE-7281449678 |
0.67 |
C1(CC/C=C(/C)\C)CC(C)C(CC=1)CO
|
|
MCULE-6489922503 |
0.67 |
OC(C1CC/C(=C(\F)/F)/CC1)=O
|
|
MCULE-1887138472 |
0.67 |
O=C1C(C)C(CC)C(C)C(CC)=C1
|
|
MCULE-1944708514 |
0.67 |
C12CC(C=C1)CC2C(C)=O
|
|
MCULE-2356606074 |
0.67 |
C1C[C@@]2(C)[C@]3([H])CC[C@H]4C(=C)C[C@@]3(C4)[C@@H](C(O)=O)[C@]2([H])[C@@](C(=O)O)(C)[C@H]1O
|
|
MCULE-7226046270 |
0.67 |
C12C(CCC(O)C=1)CC(C(OC)=O)C2
|
|
MCULE-6919539940 |
0.67 |
C12(C(=O)OC)CCC(C(=C)C)C1C1CCC3C4(C)CCC(=O)C(C)(C)C4CCC3(C)C1(CC2)C
|
|
MCULE-8204848346 |
0.67 |
C1CC2(C(O)(CO)C(=CC(=O)C2C(C1O)(C)C)C)C
|
|
MCULE-6191127237 |
0.67 |
O=C1CCC2C(=C1C)C=CC1(C)C2CC(O)C(O)C1
|
|
MCULE-4005939250 |
0.67 |
C12(C)CCC3C(CCC4CCCCC34C)C1CC(=CC(C)C)C2=O
|
|
MCULE-9392368882 |
0.67 |
C1=CC(CCC1(CCC)CCC)=O
|
|
MCULE-5160344949 |
0.67 |
O=C1C2C3C=CC(C3)C2C2C1C1CC2C=C1
|
|
MCULE-1383087393 |
0.67 |
C1=C[C@@]([H])([C@H](CC(/C=C(/C)\C)=O)C)C[C@H](O)C1=C
|
|
MCULE-6893473009 |
0.67 |
C1(C(C)CC(/C=C(\C)/C)=O)CC(O)C(=C)C=C1
|
|
MCULE-3327848610 |
0.67 |
C1(CC2(C3CCC4(C)C(C(C)(O)C(CC(=C)C(O)(C)C)O)CCC4(O)C3=CC(=O)C2CC1O)C)O
|
|
MCULE-5701533038 |
0.67 |
C1(CC(C)=CC(C)C1C(O)=O)C(OC)=O
|
|
MCULE-9871680934 |
0.67 |
C12(C)CC=C(C(=O)O)CCC1C(O)(C(O)(C)C)C(O)C2
|
|
MCULE-6976868103 |
0.67 |
OC1CC(=O)C(CCCCCCC(O)=O)C1/C=C/C(O)CCCCC
|
|
MCULE-3025026991 |
0.67 |
C[C@@]12[C@@](C#C)(O)CC[C@H]1[C@@H]1[C@@H](CC3=C([C@H]1CC2)CCC(=O)C3)C
|
|
MCULE-9290289108 |
0.67 |
C1(C)C(=O)C=CC(C(C)C)C1
|
|
MCULE-5248179465 |
0.67 |
CCCCCC(C=CC1C(CCCCCCC(=O)O)C(=O)CC1O)O
|
|
MCULE-1705600426 |
0.67 |
C12C(CCC(=O)C=1)CC(C(OC)=O)C2
|
|
MCULE-1005769729 |
0.67 |
C1C[C@]2(C)C(CC/C(/C)=C/C(=O)O)=C(C)C(=O)CC2C(C)(C)C1
|
|
MCULE-1348157475 |
0.67 |
C12CCC3[C@H](CC[C@@]3([H])[C@]1([H])CCC1=CC(=O)CCC=21)O
|
|
MolPort-046-761-785 |
0.67 |
CC1(C)CCC2=C1CC[C@H]1[C@H]2CC[C@H]2CC(=O)OC[C@]12C
|
|
MolPort-039-138-803 |
0.67 |
OCC1C[C@@H]2C[C@H]1C=C2
|
|
MolPort-009-018-334 |
0.67 |
CCCCC[C@](C)(O)\C=C\[C@H]1C(O)CC(=O)C1CCCCCCC(O)=O
|
|
MolPort-000-724-948 |
0.67 |
CC1CC(CCC=C(C)C)=CCC1C=O
|
|
MolPort-044-183-234 |
0.67 |
CCCCC[C@H](O)\C=C\[C@H]1[C@H](O)CC(=O)[C@H]1CCCCCCC(O)=O
|
|
MolPort-009-018-325 |
0.67 |
CCCCCC(O)\C=C\[C@H]1[C@@H](O)CC(=O)C1CCCCCCC(O)=O
|
|
MolPort-009-018-333 |
0.67 |
CCCCC[C@@H](O)\C=C\[C@H]1C(O)CC(=O)C1CCCCCCC(O)=O
|
|
MolPort-022-366-457 |
0.67 |
CC(C(O)=O)C1=CCCC1
|
|
MolPort-001-764-871 |
0.67 |
OC12CCC(CC1)C=C2
|
|
MolPort-002-538-677 |
0.67 |
O=C1C(CC2CCCC(C2=O)C2=CCCCC2)CCCC1C1=CCCCC1
|
|
MolPort-044-183-313 |
0.67 |
CCCC[C@H](C)C[C@H](O)\C=C\[C@H]1[C@H](O)C[C@H](O)[C@@H]1CCCCCCC(O)=O
|
|
MolPort-009-018-339 |
0.67 |
CCCCC(C)(C)C(O)\C=C\[C@H]1C(O)CC(=O)C1CCCCCCC(O)=O
|
|
MolPort-002-550-644 |
0.67 |
O=C1C(CCCC1C1=CCCCC1)C1=CCCCC1
|
|
MolPort-005-909-357 |
0.67 |
CC(C)=CCCC1=CCC(C)(CC1)C=O
|
|
MolPort-009-018-315 |
0.67 |
CCCCCC(O)\C=C\[C@H]1C(O)CC(=O)C1CCCCCCCCC(O)=O
|
|
MolPort-003-925-045 |
0.67 |
CCCCC\C=C/C\C=C/C\C=C/CCCCC(=O)OC
|
|
MolPort-039-052-558 |
0.67 |
C[C@]1(CCC[C@]2(C)[C@@H]1CC[C@@]13C[C@H](CC[C@@]21O)C(=C)C3=O)C(O)=O
|
|
MolPort-001-739-242 |
0.67 |
CC1=CC(=O)C2C(C)(C)C(O)CCC2(C)C1(O)CO
|
|
MolPort-039-052-440 |
0.67 |
COC(=O)[C@]12CC[C@H]([C@@H]1[C@H]1CC[C@@H]3[C@@]4(C)CC[C@@H](O)C(C)(C)[C@@H]4CC[C@@]3(C)[C@]1(CO)CC2)C(C)=C
|
|
MolPort-046-766-229 |
0.67 |
C[C@H]1C[C@@H]2[C@@H]3CCC4=CC(=O)C=C[C@]4(C)C3=CC[C@]2(C)[C@]1(O)C(=O)CO
|
|
MolPort-003-939-185 |
0.67 |
CCCCC[C@H](O)\C=C\[C@H]1[C@H](O)C[C@H](O)[C@@H]1CCCCCCC(O)=O
|
|
MolPort-003-939-183 |
0.67 |
CCCCC[C@H](O)\C=C\[C@H]1[C@H](O)CC(=O)[C@@H]1CCCCCCC(O)=O
|
|
MolPort-046-765-748 |
0.67 |
CC1(C2[C@H](CC[C@H]1O)[C@@H]1CC[C@@H]3C[C@]1(CC3=C)[C@H]2C(O)=O)C(O)=O
|
|
MolPort-046-765-475 |
0.67 |
C[C@]12C[C@H](O)[C@H]3C([C@@H]1CC[C@]2(O)C(=O)CO)[C@H](O)CC1=CC(=O)CC[C@]31C
|
|
MolPort-023-274-413 |
0.67 |
CC1C(O)CCC2=CC(=O)C(CC12CO)C(C)=C
|
|
MolPort-039-338-122 |
0.67 |
C[C@H](CC(=O)\C=C(\C)[C@H]1CC(=O)[C@@]2(C)C3=C(C(=O)C[C@]12C)[C@@]1(C)CCC(=O)C(C)(C)C1CC3=O)C(O)=O
|
|
MolPort-044-755-264 |
0.67 |
C[C@@]1([C@H]2[C@H](C(O)=O)[C@@]34C[C@@H](CC[C@H]3[C@@]2(CC[C@@H]1O)C(O)=O)C(=C)C4)C(O)=O
|
|
MolPort-030-042-339 |
0.67 |
CC12CCC3C(CCC4=C3CCC(=O)C4)C1CCC2(O)C#C
|
|
MolPort-003-925-864 |
0.67 |
CCCCC\C=C/C\C=C/C\C=C/C\C=C/CCCC(=O)OC
|
|
MolPort-044-567-536 |
0.67 |
C[C@@H]1CC2C3CCC4=CC(=O)C=CC4(C)C3=CCC2(C)[C@@]1(O)C(=O)CO
|
|
MolPort-009-018-298 |
0.67 |
CCCCCC(O)\C=C\[C@@H]1C(C\C=C/CCCC(O)=O)C(O)CC1=C
|
|
MolPort-035-862-149 |
0.67 |
OCC1CCC=CCC1
|
|
MolPort-039-338-613 |
0.67 |
C[C@@H]1CC[C@@]2(CC[C@]3(C)C(=CC[C@@H]4[C@]5(C)[C@@H](CC[C@@]34C)[C@@](C)(CO)C=C5CO)[C@@H]2[C@]1(C)O)C(O)=O
|
|
MolPort-000-832-089 |
0.67 |
OCC1CC2CC1C=C2
|
|
MolPort-003-850-554 |
0.67 |
C[C@@H]1CC2=C(CCC(=O)C2)[C@H]2CC[C@@]3(C)[C@@H](CC[C@@]3(O)C#C)[C@H]12
|
|
MolPort-000-830-394 |
0.67 |
C[C@]12CCC3C(CCC4=C3CCC(=O)C4)C1CC[C@@]2(O)C#C
|
|
MolPort-046-764-443 |
0.67 |
CC[C@]12CC[C@H]3[C@@H](CC[C@H]4CC(=O)CC=C34)[C@@H]1CC[C@@]2(O)C#C
|
|
MolPort-046-792-915 |
0.67 |
C[C@]12CCC3=C4CC[C@H](O)C=C4CC[C@H]3[C@H]1CCC2=O
|
|
MolPort-000-829-390 |
0.67 |
CC1CC(CCC=C(C)C)=CCC1(C)C(C)=O
|
|
MolPort-009-018-290 |
0.67 |
CCCCCC(O)\C=C\[C@@H]1C(CCCCCCC(O)=O)C(O)CC1=O
|
|
MolPort-046-790-431 |
0.67 |
CC1(C)C[C@H]2C3=CC[C@@H]4[C@@]5(C)CC[C@H](O)[C@](C)(CO)[C@@H]5CC[C@@]4(C)[C@]3(C)CC[C@@]2(C)C=C1
|
|
MolPort-046-763-170 |
0.67 |
CCCCCC(=O)\C=C\[C@@H]1[C@H](O)CC(=O)[C@@H]1CCCCCCC(O)=O
|
|
MolPort-023-331-417 |
0.67 |
CCC12CC(=C)[C@H]3[C@@H](CCC4=CCCC[C@H]34)[C@@H]1CCC2=O
|
|
MolPort-027-634-787 |
0.67 |
OC(=O)C1(CCC=C)CC1
|
|
MolPort-044-183-215 |
0.67 |
CC\C=C/C\C=C/C\C=C/C\C=C/C\C=C/CCCCC(=O)OC
|
|
MolPort-039-052-543 |
0.67 |
C[C@@]1(CC[C@H]2C(CC[C@H]3[C@](C)(CO)[C@@H](O)CC[C@]23C)=C1)C=C
|
|
MolPort-046-509-816 |
0.67 |
OC(=O)C1CCC(CC1)=C(F)F
|
|
MolPort-002-524-638 |
0.67 |
COC(=O)[C@]12CC[C@H](C1[C@H]1CC[C@@H]3[C@@]4(C)CCC(=O)C(C)(C)C4CC[C@@]3(C)[C@]1(C)CC2)C(C)=C
|
|
MolPort-039-138-885 |
0.67 |
CCCCCC(=O)\C=C\[C@H]1[C@H](O)C[C@H](O)[C@@H]1CCCCCCC(O)=O
|
|
MolPort-006-115-641 |
0.67 |
CCCC1CC(C)=CC(=O)C1
|
|
MolPort-038-386-038 |
0.67 |
C[C@@]12CC[C@H](O)[C@](C)([C@H]1[C@H](C(O)=O)[C@@]13C[C@@H](CC[C@@H]21)C(=C)C3)C(O)=O
|
|
MolPort-028-599-742 |
0.67 |
O[C@H]1CC[C@@H]2C1CCC1=C3CCC(=O)C=C3CC[C@@H]21
|
|
MolPort-046-509-025 |
0.67 |
C[C@@H](CC(=O)C=C(C)C)[C@H]1C[C@H](O)C(=C)C=C1
|
|
MolPort-039-338-964 |
0.67 |
C[C@H](C\C=C\C(C)=C)[C@H]1CC[C@@]2(C)[C@@H]3[C@@H](O)C=C4[C@@H](CC[C@H](O)C4(C)C)[C@@]3(CC[C@]12C)C=O
|
|
MolPort-020-001-257 |
0.67 |
CCCCCC(O)\C=C\C1C(O)CC(=O)C1CCCCCCC(O)=O
|
|
MolPort-001-994-226 |
0.67 |
COC(=O)C1CC(C)=CC(C)C1C(O)=O
|
|
MolPort-002-510-832 |
0.67 |
C[C@]12CCC3=C4CCC(=O)C=C4CC[C@H]3C1CC[C@@H]2O
|
|
MolPort-006-120-169 |
0.67 |
C[C@@H]1C[C@H]2[C@@H]3CCC4=CC(=O)C=C[C@]4(C)C3=CC[C@]2(C)[C@@]1(O)C(=O)CO
|
|
MolPort-027-640-985 |
0.67 |
CCCCC[C@H](O)\C=C\[C@@H]1[C@@H](CCCCCCC(O)=O)C(=O)CC1=O
|
|
MolPort-006-123-523 |
0.67 |
OC(=O)CC1=CCCC1
|
|
MolPort-009-018-933 |
0.67 |
CC\C=C/C\C=C/C\C=C/C\C=C/CCCCC(=O)OC
|
|
MolPort-000-706-606 |
0.67 |
[Na+].CC1(C)C2CCC(C2)(C([O-])=O)C1=C
|
|
MolPort-027-640-984 |
0.67 |
CCCCC\C=C/C=C1\[C@@H](C\C=C/CCCC(O)=O)CCC1=O
|
|
MolPort-046-158-507 |
0.67 |
C[C@@H](CCC=C(C)C)[C@H]1CCC(C)=CC1=O
|
|
MolPort-002-517-197 |
0.67 |
COC(=O)[C@]12CC[C@H](C1[C@H]1CCC3[C@@]4(C)CC[C@@H](O)C(C)(C)C4CC[C@@]3(C)[C@]1(C)CC2)C(C)=C
|
|
MolPort-035-765-998 |
0.67 |
O=CC1C[C@@H]2C[C@H]1C=C2
|
|
MolPort-039-139-023 |
0.67 |
CCCCC[C@H](O)\C=C\[C@H]1[C@H](O)CC(=C)[C@@H]1C\C=C/CCCC(O)=O
|
|
MolPort-039-139-024 |
0.67 |
CCCCC(C)(C)[C@H](O)\C=C\[C@H]1[C@H](O)CC(=C)[C@@H]1C\C=C/CCCC(O)=O
|
|
MolPort-006-133-148 |
0.67 |
CC(O)C(C)CCC1CC=C(C)C1(C)C
|
|
MolPort-006-147-720 |
0.67 |
C[C@]12CC[C@H]3[C@@H](CCC4=C3CCC(=O)C4)[C@@H]1CC[C@@]2(O)C#C
|
|
MolPort-002-506-951 |
0.67 |
CCC[C@@H]1CC(C)=CC(=O)C1
|
|
MolPort-002-513-687 |
0.67 |
CC1=C(CC2C(CCCC2(C)C)C1)C=O
|
|
MolPort-002-513-677 |
0.67 |
CC1CC(CCC=C(C)C)=CCC1CO
|
|
MolPort-006-394-736 |
0.67 |
CCCCCC(=O)\C=C\[C@H]1[C@H](O)CC(=O)[C@@H]1CCCCCCC(O)=O
|
|
MolPort-006-114-153 |
0.67 |
COC(=O)[C@]12CC[C@H]([C@@H]1[C@H]1CC[C@@H]3[C@@]4(C)CC[C@H](O)C(C)(C)[C@@H]4CC[C@@]3(C)[C@]1(C)CC2)C(C)=C
|
|
MolPort-002-513-028 |
0.67 |
CCCCC[C@H](O)\C=C\[C@H]1CCC(=O)[C@@H]1CCCCCCC(=O)OC
|
|
MolPort-013-791-457 |
0.67 |
O=C(C1CCCCC1)C1=CCCCC1
|
|
MolPort-046-647-352 |
0.67 |
OC[C@@H]1C[C@H]2C[C@@H]1C=C2
|
|
MolPort-006-701-571 |
0.67 |
C[C@]12CCC3=C4CCC(=O)C=C4CCC3C1CCC2O
|
|
MolPort-042-676-343 |
0.67 |
O=CC1CC2CC1C=C2
|
|
MolPort-002-507-754 |
0.67 |
CC(=O)C1CC2CC1C=C2
|
|
MolPort-035-706-554 |
0.67 |
CC(=O)O[C@H]1CC[C@@]2(C)[C@@H](CC[C@]3(C)[C@@H]2C(=O)C=C2[C@@H]4CC(C)(C)CC[C@]4(C)CC[C@@]32C)C1(C)C
|
|
MolPort-042-694-227 |
0.67 |
[NaH].CC(C)CCC[C@@H](C)[C@H]1CCC2[C@H]3CCC4CC(O)=CC[C@]4(C)[C@@H]3CC[C@]12C
|
|
MolPort-027-640-899 |
0.67 |
CCCCC[C@H](O)\C=C\[C@H]1[C@H](O)C[C@@H](O)[C@H]1CCCCCCC(O)=O
|
|
MolPort-000-157-846 |
0.67 |
O=CC1CC2CC1C=C2
|
|
MolPort-046-424-021 |
0.67 |
COC(=O)C12CCC(C1C1CCC3[C@@]4(C)CCC(=O)C(C)(C)C4CC[C@@]3(C)[C@]1(C)CC2)C(C)=C
|
|
MolPort-042-694-347 |
0.67 |
C[C@]12CCC3=C4CCC(=O)C=C4CC[C@H]3[C@@H]1CC[C@@H]2O
|
|
MolPort-001-793-711 |
0.67 |
CC(=O)C1C[C@@H]2C[C@H]1C=C2
|
|
MolPort-027-640-898 |
0.67 |
CCCCC[C@H](O)\C=C\[C@H]1[C@H](O)C[C@H](O)[C@H]1CCCCCCC(O)=O
|
|
MolPort-028-610-103 |
0.67 |
C\C(CCC1=C(C)C(=O)CC2C(C)(C)CCC[C@]12C)=C/C(O)=O
|
|
MolPort-042-675-478 |
0.67 |
CC(CC(=O)C=C(C)C)C1CC(O)C(=C)C=C1
|
|
MolPort-027-640-900 |
0.67 |
CCCCC[C@H](O)\C=C\[C@H]1[C@H](O)C[C@@H](O)[C@@H]1CCCCCCC(O)=O
|
|
MolPort-042-675-450 |
0.67 |
CC(C)(O)C1(O)C(O)CC2(C)CC=C(CCC12)C(O)=O
|
|
MolPort-039-338-438 |
0.67 |
CC1(C)CC[C@@]2(CC[C@]3(C)C(C=C[C@@H]4[C@@]5(C)C[C@@H](O)[C@H](O)C(C)(C)[C@@H]5CC[C@@]34C)=C2C1)C(O)=O
|
|
MolPort-039-138-846 |
0.67 |
CCCCC[C@H](O)\C=C\[C@H]1[C@@H](O)C[C@@H](O)[C@@H]1CCCCCCC(O)=O
|
|
MolPort-006-110-398 |
0.67 |
CC(C)C1CCC(C)=CC1=O
|
|
MolPort-035-706-310 |
0.66 |
CC1(C)C=C(CO)[C@@]2(C)[C@H]1CC[C@]1(C)[C@@H]2CC=C2[C@@H]3[C@H](O)C(C)(C)CC[C@@]3(CC[C@@]12C)C(O)=O
|
|
MolPort-035-706-518 |
0.66 |
C[C@@H](O)[C@H]1CC[C@H]2[C@@H]3C=CC4=CC(=O)CC[C@]4(C)[C@H]3CC(=O)[C@]12C
|
|
MolPort-027-640-896 |
0.66 |
CCCCC[C@H](O)\C=C\[C@H]1[C@H](O)C[C@H](O)[C@@H]1CC(=O)CCCCC(O)=O
|
|
MolPort-039-338-128 |
0.66 |
C[C@H](CC(O)\C=C(/C)C(O)=O)[C@H]1CC(=O)[C@@]2(C)C3=C(C(=O)C[C@]12C)[C@@]1(C)CC[C@H](O)C(C)(C)C1CC3=O
|
|
MolPort-002-537-790 |
0.66 |
CC(C12CC3CC(CC(C3)C1)C2)[N+](C)(C)C.CC(C)C1=CC2=CCC3C(C)(CCCC3(C)C([O-])=O)C2CC1
|
|
MolPort-044-754-151 |
0.66 |
CC(C)C(=C)CC[C@H]([C@H]1[C@H](O)C[C@@]2(C)C3=C[C@H](O)[C@H]4C(C)(C)C(=O)CC[C@]4(C)C3=CC[C@]12C)C(O)=O
|
|
MolPort-035-706-436 |
0.66 |
C[C@@H]1CC[C@@]2(CC[C@]3(C)C(=CC[C@@H]4[C@]5(C)[C@@H](CC[C@@]34C)C(C)(C)C=C5CO)[C@@H]2[C@]1(C)O)C(O)=O
|
|
MolPort-046-765-411 |
0.66 |
C[C@]12CC[C@H]3[C@@H](CCC4=CC(=O)CC[C@H]34)[C@@H]1C[C@H](O)C2(O)C#C
|
|
MolPort-042-675-426 |
0.66 |
COC(=O)C(C)(C)C1CC[C@]2(C)C(CC=C3[C@@H]4[C@](C)(O)[C@H](C)CC[C@@]4(CC[C@@]23C)C(O)=O)[C@@]1(C)CC(O)=O
|
|
MolPort-009-018-302 |
0.66 |
CCCCCC(O)C\C=C1/C(C\C=C/CCCC(O)=O)C(O)CC1=O
|
|
MolPort-002-800-509 |
0.66 |
CC(C)(C)OC1CCC2(C)C3CCC4(C)C(CCC4=O)C3CC=C2C1
|
|
MolPort-046-697-204 |
0.66 |
C\C(=C/CO)C1C(C)=CC2CC(C)(O)CC(C2C1(C)C(=O)CCO)C(O)=O
|
|
MolPort-039-138-875 |
0.66 |
C[C@@H](O)CCC[C@@H](O)\C=C\[C@H]1[C@H](O)CC(=O)[C@@H]1C\C=C/CCCC(O)=O
|
|
MolPort-035-706-385 |
0.66 |
CCCCCCCCCCCCCCCC(=O)O[C@H]1CC[C@@]2(C)[C@@H](CC[C@]3(C)[C@@H]2CC=C2[C@@H]4CC(C)(C)CC[C@]4(CO)CC[C@@]32C)C1(C)C
|
|
MolPort-046-153-163 |
0.66 |
CC12CC(=O)C3=C(C(O)CC4C(C)(C)C(=O)CCC34C)C1(C)C(O)CC2C(=C)CCC(O)=O
|
|
MolPort-002-511-922 |
0.66 |
C[C@]12CCC3C(CCC4=CC(=O)CC[C@]34C)C1C[C@@H](O)[C@]2(O)C#N
|
|
MolPort-002-508-969 |
0.66 |
C[C@]12CCC3C(CCC4=CC(=O)CC[C@]34C)C1CC[C@]2(O)C(=O)CBr
|
|
MolPort-027-640-887 |
0.66 |
C[C@@H](O)CCC[C@H](O)\C=C\[C@H]1[C@H](O)CC(=O)[C@@H]1C\C=C/CCCC(O)=O
|
|
MolPort-039-338-130 |
0.66 |
CC(CC(=O)C[C@](C)(O)C1CC(=O)[C@@]2(C)C3=C(C(=O)C[C@]12C)[C@@]1(C)CCC(=O)C(C)(C)C1C[C@@H]3O)C(O)=O
|
|
MolPort-039-338-980 |
0.66 |
C[C@H](CC(=O)C[C@@H](C)C(O)=O)[C@H]1C[C@H](O)[C@@]2(C)C3=C(C(=O)C[C@]12C)[C@@]1(C)CC[C@H](O)C(C)(C)C1C[C@@H]3O
|
|
MolPort-046-153-067 |
0.66 |
CC(C1CCC2C3=C(CCC12C)C1(C)CCC(O)C(C)(C)C1(O)CC3)C(=O)\C=C(/C)C(C)(C)O
|
|
MolPort-044-649-713 |
0.66 |
COC(=O)[C@]12CCC(C)(C)C[C@H]1C1=CC[C@@H]3[C@@]4(C)C\C(=C\O)C(=O)C(C)(C)[C@@H]4CC[C@@]3(C)[C@]1(C)CC2
|
|
MCULE-4026127058 |
0.66 |
C(C)(=O)OC1CCC2(C)C(C1)(CC(C1C3CCC(C(C)C=CC(C)C(C)C)C3(C)CCC2=1)=O)[H]
|
|
MCULE-4207394958 |
0.66 |
C1(C(C)=CC2C(C1(C)C(CCO)=O)C(C(=O)O)CC(C)(O)C2)/C(=C/CO)/C
|
|
MCULE-5590608344 |
0.66 |
[C@]12(C)CCC[C@@](C)(C(O)=O)[C@]1([H])CCC1=C[C@@](CC[C@]12[H])(C)C=C.N1CCCCC1
|
|
MCULE-3531952070 |
0.66 |
C1CC2(C)C3CCC4(C)C(C(C(=O)/C=C(\C)/C(O)(C)C)C)CCC4C=3CCC2(O)C(C)(C)C1O
|
|
MCULE-4546155810 |
0.66 |
[C@]12(C)CCC3C(CCC4=CC(=O)CC[C@]34C)C1C[C@@H](O)[C@]2(O)C#N
|
|
MCULE-8374344586 |
0.66 |
O=C1C(CCC2CCCCC=2)COC1
|
|
MCULE-7060204243 |
0.66 |
CC1C(CCC2CCCCC=2)C(=O)CO1
|
|
MCULE-4633610104 |
0.66 |
C(=O)(OC)C(C)(C)C1CC[C@@]2(C)[C@]3(C)CC[C@@]4(C(=O)O)CC[C@@H](C)[C@](O)(C)[C@@]4([H])C3=CCC2[C@@]1(C)CC(=O)O
|
|
MCULE-1128702855 |
0.66 |
C1C[C@]2(C)[C@@]3([H])CC(=O)[C@]4(C)[C@@]([H])([C@@H](C)O)CC[C@@]4([H])[C@]3([H])C=CC2=CC1=O
|
|
MCULE-4227913812 |
0.66 |
[C@]12(C)CCC3C(CCC4=CC(=O)CC[C@]34C)C1CC[C@]2(O)C(CBr)=O
|
|
MCULE-2637255261 |
0.66 |
C1C2C=CC3C(C(O)=O)C(C23)C=1
|
|
MCULE-1608951387 |
0.66 |
C(=C/CC)/CC(/C=C/C(O)C(O)CCCCCCCC(=O)O)O
|
|
MCULE-5078166082 |
0.66 |
C1C[C@@]2([H])[C@@](C)(CC[C@H]([C@@]2(CC/C(/C=O)=C\C(=O)O)C)C)C(C)=C1
|
|
MCULE-7172594390 |
0.66 |
C1C[C@@]2([H])[C@@](CC[C@H]([C@]2(C)CC/C(=C/C(=O)O)/CO)C)(C(CO)=C1)C
|
|
MCULE-7083384019 |
0.66 |
CC1=C2C[C@H](C(=C)C)CC[C@@]2(C)CCC1=O
|
|
MCULE-6837855043 |
0.66 |
C12(C(C)=O)C3C4C5C(C1(C(C)=O)C4C=C3)C=CC25
|
|
MCULE-2870645391 |
0.66 |
C12(C3C4C5C1C=CC5C2(CO)C4C=C3)CO
|
|
MCULE-2123440957 |
0.66 |
CC1C2(C)C(=CC(C3C(C)(C)C32)=O)CCC1
|
|
MCULE-8099197121 |
0.66 |
C1(=O)C[C@@]2([H])[C@H](C)CC(=O)[C@@H](C(C)C)[C@@]2([H])C=C1C
|
|
MCULE-6567295142 |
0.66 |
C1=CC2C3C4C5C6(C(O)CC5C5CC(O)C26C54)C13
|
|
MCULE-6534635803 |
0.66 |
C12(CC1)C1C=CC2C2C1C(=O)C1C(C2=O)C2C3(CC3)C1C=C2
|
|
MCULE-4355376092 |
0.66 |
C1C[C@]2(C)[C@@]3([H])CC[C@]4(C)[C@@]([H])([C@@H](CC[C@@H](CC)C(C)C)C)CC[C@@]4([H])[C@]3([H])C[C@@H](O)C2=C[C@H]1O
|
|
MCULE-2344630269 |
0.66 |
C1(CCC(C)=O)=C(C)C(=O)CC2C(CCC[C@]12C)(C)C
|
|
MCULE-7821346211 |
0.66 |
C123C4C5C6C(C1(C(=O)CCC2=O)C5C=C4)C=CC36
|
|
MCULE-7051793102 |
0.66 |
C1C[C@]2(C)CC[C@@H](C(C)=C)CC2=C(C)C1=O
|
|
MCULE-6135208734 |
0.66 |
CC1([C@@H]2C(C=C3[C@@](C)([C@H]12)[C@H](C)CCC3)=O)C
|
|
MCULE-5384019764 |
0.66 |
C12CC(CCC1(C)CCC(=O)C=2C)C(C)=C
|
|
MCULE-6079251175 |
0.66 |
C1CC2(C(O)CC(CC2C(C1)(C)O)C(C(=O)O)=C)C
|
|
MCULE-8765746285 |
0.66 |
C1C(O)C2(C)CCC(C(C(O)=O)=C)C(O)C2C(C)(O)C1
|
|
MCULE-4894965151 |
0.66 |
[H]C12CC(OC)CCC1(C)C1CCC3(C)C(C(C)C=CC(C)C(C)C)CCC3C=1CC2
|
|
MCULE-1235419293 |
0.66 |
O=C1CCC2(C)C3CCC4(C)C(CCC4C3CC(C2=C1)=O)C(C)=O
|
|
MCULE-8706542409 |
0.66 |
C12(C)C3C(C4C(C)(CC3)CCC=4)CCC1=CC(=O)CC2
|
|
MCULE-2318177037 |
0.66 |
C1C[C@]2(C)[C@@]3([H])CC[C@]4(C)[C@@]([H])([C@@H](CC[C@@H](CC)C(C)C)C)CC[C@@]4([H])[C@]3([H])CC(=O)C2=CC1=O
|
|
MCULE-4436654330 |
0.66 |
C1=CC2C3CC3C1C(CO)C2CO
|
|
MCULE-7642080407 |
0.66 |
C12C=CC3C4C1C(=O)C1C(C4=O)C3C21
|
|
MCULE-7535047148 |
0.66 |
CC12CCC(=O)C=C1C(=O)CC1C2CCC2(C)C1CCC2=O
|
|
MCULE-2325358551 |
0.66 |
C1(C(CC)=O)C(C)=CCC(C(C)C)C1
|
|
MCULE-9426101692 |
0.66 |
OC(C1CC=CCC1)CC1CC=CC1
|
|
MCULE-5354591097 |
0.66 |
C1=C(C)CC[C@@H](C(C)C)C(=O)CC(=C)CC1
|
|
MCULE-2856968398 |
0.66 |
C1=CC2C3C4C(C(CCO)C13)C=CC4C2CCO
|
|
MCULE-8152778304 |
0.66 |
C1(CO)(CO)CCC(=CC1)C
|
|
MCULE-4098753787 |
0.66 |
C12C(=O)CCC(C(=C)CCC1C(C)(C)C2)O
|
|
MCULE-6347475200 |
0.66 |
C(CCCCCC)(C1C=CCCC1)O
|
|
MCULE-7790352459 |
0.66 |
C[C@@]1([C@H](CC2CCCC=2)CCCC1)O
|
|
MCULE-7044206712 |
0.66 |
C1(C(O)C)C(C)=CCCC1
|
|
MCULE-5145834120 |
0.66 |
C1(C)(C(C)=C)CC1C(O)=O
|
|
MCULE-1536375497 |
0.66 |
CC1(C(CC2CCCC=2)CCCC1)O
|
|
MCULE-5486459234 |
0.66 |
OC(C1(CC2(CCC2)C1)CC=C)=O
|
|
MCULE-4617598220 |
0.66 |
CC(C1(C(O)=O)CC2(CCC2)C1)C=C
|
|
MCULE-1327121373 |
0.66 |
CC(CC1(C(O)=O)CC2(CCC2)C1)=C
|
|
MCULE-2989209658 |
0.66 |
C1(CO)(CO)CC=C(CC1C)C
|
|
MCULE-7389041577 |
0.66 |
CC1=C(CC=O)C(C)(C)CCC1
|
|
MCULE-7703543535 |
0.66 |
C1(C)(CC/C=C(\C)/C)CC(C)(C)CC(=O)C1
|
|
MCULE-9513927762 |
0.66 |
CC1C2(C)CCC3C4(C)CCC(CC/C=C(\C)/C)(C)CC4(C)CCC3(C)C2CCC1=O
|
|
MCULE-8949375623 |
0.66 |
C/C(/C)=C/CCC1CC(O)CCC1
|
|
MCULE-9484484276 |
0.66 |
C1C[C@@]2([H])[C@]3(C)CC[C@@]4(C)C[C@@](CC/C=C(/C)\C)(C)CC[C@]4(C)[C@@]3([H])CC[C@]2(C)[C@@H](C)C1=O
|
|
MolPort-019-937-276 |
0.66 |
CC1(C)C[C@H]2[C@H]1CC(=O)\C(CO)=C/CCC2=C
|
|
MolPort-006-118-915 |
0.66 |
CCCCNCCCC.CCCCCCCC\C=C/CCCCCCCC(O)=O
|
|
MolPort-046-793-096 |
0.66 |
CC(=O)[C@H]1CC[C@H]2C3=CC=C4C[C@@H](O)CC[C@]4(C)[C@H]3CC[C@]12C
|
|
MolPort-001-740-962 |
0.66 |
CCC(O)C(O)\C=C/C\C=C/CCCCCCCCC(O)=O
|
|
MolPort-001-740-031 |
0.66 |
CC\C=C/CC(O)\C=C\C(O)C(O)CCCCCCCC(O)=O
|
|
MolPort-046-690-128 |
0.66 |
CC(=O)[C@H]1CC[C@H]2C3=CC=C4C[C@@H](O)CC[C@@]4(C)[C@@H]3CC[C@]12C
|
|
MolPort-038-386-585 |
0.66 |
OC(CCCCCCCC(O)=O)\C=C\C(O)=O
|
|
MolPort-005-944-829 |
0.66 |
C[C@@H]1CC[C@]2(C)[C@H](CCC=C2C)[C@@]1(C)CC\C(C=O)=C/C(O)=O
|
|
MolPort-005-944-839 |
0.66 |
C[C@@H]1CC[C@]2(C)[C@H](CCC=C2CO)[C@@]1(C)CC\C(CO)=C\C(O)=O
|
|
MolPort-039-338-118 |
0.66 |
C[C@H](CC\C=C(/C)C=O)[C@H]1CC[C@@]2(C)C3=C(CC[C@]12C)[C@@]1(C)CCC(=O)C(C)(C)C1CC3=O
|
|
MolPort-044-723-271 |
0.66 |
C[C@@]12CCC[C@](C)([C@H]1CC[C@@]13CC(C[C@H](O)[C@@H]21)C(=C)[C@H]3O)C(O)=O
|
|
MolPort-039-338-103 |
0.66 |
CC[C@H](CC[C@@H](C)[C@H]1CC[C@H]2[C@@H]3C[C@@H](O)C4=C[C@@H](O)CC[C@]4(C)[C@H]3CC[C@]12C)C(C)C
|
|
MolPort-044-723-195 |
0.66 |
C[C@@H]1CCCC2=CC(=O)[C@@H]3[C@@H](C3(C)C)[C@@]12C
|
|
MolPort-035-679-062 |
0.66 |
C[C@]12CC[C@H]3[C@@H](CC(=O)C4=CC(=O)CC[C@]34C)[C@@H]1CCC2=O
|
|
MolPort-046-594-365 |
0.66 |
CC(=C)C1CCC2(C)CCC(=O)C(C)=C2C1
|
|
MolPort-002-279-706 |
0.66 |
O=C1C2C3C=CC(C2C(=O)C2C4C=CC(C12)C41CC1)C31CC1
|
|
MolPort-046-691-486 |
0.66 |
CC(=O)[C@H]1CC[C@H]2[C@@H]3CC(=O)C4=CC(=O)CC[C@]4(C)[C@H]3CC[C@]12C
|
|
MolPort-023-298-997 |
0.66 |
CC[C@H](CC[C@@H](C)[C@H]1CC[C@H]2[C@@H]3CC(=O)C4=CC(=O)CC[C@]4(C)[C@H]3CC[C@]12C)C(C)C
|
|
MolPort-001-742-167 |
0.66 |
CC1(O)CCCC2(C)C(O)CC(CC12)C(=C)C(O)=O
|
|
MolPort-020-005-765 |
0.66 |
CC(=C)[C@@H]1CC[C@@]2(C)CCC(=O)C(C)=C2C1
|
|
MolPort-035-706-207 |
0.66 |
CC(C)[C@H]1[C@H]2C=C(C)C(=O)C[C@H]2[C@H](C)CC1=O
|
|
MolPort-039-338-152 |
0.66 |
C[C@@]12CCC[C@](C)([C@H]1CC[C@@]13C[C@H](C[C@H](O)[C@@H]21)C(=C)[C@H]3O)C(O)=O
|
|
MolPort-046-600-627 |
0.66 |
CC(=O)CCC1=C(C)C(=O)CC2C(C)(C)CCC[C@]12C
|
|
MolPort-039-338-246 |
0.66 |
CC[C@H](\C=C\[C@@H](C)[C@H]1CC[C@H]2[C@@H]3C[C@@H](O)C4=C[C@@H](O)CC[C@]4(C)[C@H]3CC[C@]12C)C(C)C
|
|
MolPort-002-911-095 |
0.66 |
CC(C)CCCC(C)C1CCC2C3CC(O)C4=CC(O)CCC4(C)C3CCC12C
|
|
MolPort-027-845-391 |
0.66 |
CC1CCC=C(C)C1C=O
|
|
MolPort-001-790-179 |
0.66 |
CC1=CCCC(C)(C)C1C=O
|
|
MolPort-002-507-398 |
0.66 |
CCC(=O)C1CC(CC=C1C)C(C)C
|
|
MolPort-035-706-381 |
0.66 |
CC(=C)[C@@H]1CC[C@]2(C)CC[C@]3(C)[C@H](CC[C@@H]4[C@@]5(C)[C@H](O)CC(=O)C(C)(C)[C@@H]5CC[C@@]34C)[C@@H]12
|
|
MolPort-000-713-824 |
0.66 |
CC1=CCC(CO)(CO)CC1
|
|
MolPort-001-794-307 |
0.66 |
CC1=C(CC=O)C(C)(C)CCC1
|
|
MolPort-021-804-772 |
0.66 |
OC(=O)CCC(CCCCCCCCC=C)C(O)=O
|
|
MolPort-004-769-150 |
0.66 |
OC(=O)C1(CC=C)CCCC1
|
|
MolPort-046-594-553 |
0.66 |
OC(=O)C1CCC(=C)C1
|
|
MolPort-035-706-243 |
0.66 |
CC(C)[C@@H]1CC\C(C)=C\CCC(=C)CC1=O
|
|
MolPort-044-831-889 |
0.66 |
OC(=O)C1(CCC1)C1(CCC1)C=C
|
|
MolPort-005-944-220 |
0.66 |
OC(=O)CCC(CCCCCCC=C)C(O)=O
|
|
MolPort-000-738-432 |
0.66 |
CC1CC(C)=CCC1(CO)CO
|
|
MolPort-002-025-510 |
0.66 |
CC1(C)CC2C1CCC(=C)C(O)CCC2=O
|
|
MolPort-046-702-738 |
0.66 |
C\C=C(/C)CCCC(C)(C)O
|
|
MolPort-003-960-121 |
0.66 |
CC\C=C/CCCCCO
|
|
MolPort-046-594-349 |
0.66 |
CC1C(=O)CCC2C1(C)CCC1C2(C)CCC2(C)CC(C)(CCC=C(C)C)CCC12C
|
|
MolPort-020-005-764 |
0.66 |
C[C@H]1C(=O)CC[C@@H]2[C@]1(C)CC[C@H]1[C@@]2(C)CC[C@@]2(C)C[C@](C)(CCC=C(C)C)CC[C@]12C
|
|
MolPort-046-596-285 |
0.65 |
CC(=O)OC1CCC2C3CCC4=CC(=O)CC[C@]4(C)C3CC[C@]12C
|
|
MolPort-002-519-875 |
0.65 |
CC(=O)[C@@]1(O)CCC2[C@@H]3CC=C4C[C@H](CC[C@]4(C)C3CC[C@]12C)OC=O
|
|
MolPort-046-762-562 |
0.65 |
CC(=O)OC1(C)CC[C@@H]2[C@@H]3CCC4=CC(=O)CC[C@@H]4[C@@H]3CC[C@]12C
|
|
MolPort-046-510-831 |
0.65 |
OC(=O)C1(CC2CC1C=C2)C#N
|
|
MolPort-003-873-418 |
0.65 |
CC(=O)OC1CCC2C3CCC4=CC(=O)CCC4(C)C3CCC12C
|
|
MolPort-002-508-571 |
0.65 |
CC(=O)O[C@H]1CCC2[C@@H]3CCC4=CC(=O)CCC4C3CC[C@]12C
|
|
MolPort-046-596-338 |
0.65 |
CC(=O)OC1CCC2C3CCC4=CC(=O)CCC4C3CC[C@]12C
|
|
MolPort-001-793-877 |
0.65 |
CCOC(=O)C1CC2CC1C=C2
|
|
MolPort-044-755-207 |
0.65 |
CC(=O)O[C@H]1CC[C@H]2[C@@H]3CCC4CC(=O)C=C[C@]4(C)[C@H]3CC[C@]12C
|
|
MolPort-002-528-923 |
0.65 |
CC(=O)O[C@H]1CC[C@H]2[C@@H]3CCC4=CC(=O)CC[C@]4(C)[C@H]3CC[C@]12C
|
|
MolPort-046-596-253 |
0.65 |
CC(=O)[C@@]1(O)CCC2C3CC=C4CC(CC[C@]4(C)C3CC[C@]12C)OC=O
|
|
MolPort-035-706-462 |
0.65 |
C[C@@H]1CC[C@@]2(CC[C@]3(C)C(=CC[C@@H]4[C@@]5(C)C=C(O)C(=O)C(C)(C)[C@@H]5CC[C@@]34C)[C@@H]2[C@]1(C)O)C(O)=O
|
|
MolPort-006-823-213 |
0.65 |
CC(=O)O[C@@]1(C)CC[C@H]2[C@@H]3CCC4=CC(=O)CC[C@@H]4[C@H]3CC[C@]12C
|
|
MolPort-001-739-243 |
0.65 |
CC1=CC(=O)C2C(C)(C)CC(O)CC2(C)C1(O)CO
|
|
MolPort-005-938-238 |
0.65 |
CC(C)(C)OC(=O)C1CC2CC1C=C2
|
|
MolPort-006-111-314 |
0.65 |
CC(=O)O[C@H]1CC[C@H]2[C@@H]3CC[C@H]4CC(=O)C=C(C)[C@]4(C)[C@H]3CC[C@]12C
|
|
MolPort-006-117-087 |
0.65 |
CC(=O)[C@@]1(O)C(=C)C[C@H]2[C@@H]3C=C(C)C4=CC(=O)CC[C@]4(C)[C@H]3CC[C@]12C
|
|
MolPort-046-697-317 |
0.65 |
CC(C)C1CC(O)C2(C)CCC3(CO)CC4=C(CCC4C4(C)CC4C3C12)C(O)=O
|
|
MolPort-046-589-853 |
0.65 |
CCCCCC(C)(O)\C=C\[C@H]1[C@H](O)C[C@H](O)[C@@H]1C\C=C/CCCC(O)=O
|
|
MolPort-044-183-342 |
0.65 |
CCCCC[C@@](C)(O)\C=C\[C@H]1[C@H](O)C[C@H](O)C1C\C=C/CCCC(O)=O
|
|
MolPort-006-391-948 |
0.65 |
CCCCC[C@](C)(O)\C=C\[C@H]1[C@H](O)C[C@H](O)[C@@H]1C\C=C/CCCC(O)=O
|
|
MolPort-009-018-343 |
0.65 |
CCCCC(C)(O)C\C=C\[C@H]1C(O)CC(=O)C1CCCCCCC(=O)OC
|
|
MolPort-027-640-972 |
0.65 |
CCCCCCC[C@H](O)\C=C\[C@H]1[C@H](O)C[C@H](O)[C@@H]1C\C=C/CCCC(O)=O
|
|
MolPort-027-640-946 |
0.65 |
CCCCC(C)(C)[C@H](O)\C=C\[C@H]1[C@H](O)C[C@H](O)[C@@H]1C\C=C/CCCC(O)=O
|
|
MolPort-027-640-919 |
0.65 |
CCCCC[C@H](O)\C=C\[C@H]1[C@H](O)C[C@H](O)[C@@H]1C\C=C\CCCC(O)=O
|
|
MolPort-027-640-922 |
0.65 |
CCCCC[C@H](O)\C=C\[C@H]1[C@H](O)C[C@@H](O)[C@H]1C\C=C/CCCC(O)=O
|
|
MolPort-009-018-236 |
0.65 |
CCCCC(C)(O)C\C=C\[C@H]1C(O)CC(=O)[C@H]1CCCCCCC(=O)OC
|
|
MolPort-003-666-830 |
0.65 |
CCCCC(C)(O)C\C=C\[C@H]1[C@H](O)CC(=O)[C@@H]1CCCCCCC(=O)OC
|
|
MolPort-027-640-925 |
0.65 |
CCCCC[C@@H](O)\C=C\[C@H]1[C@H](O)C[C@H](O)[C@H]1C\C=C/CCCC(O)=O
|
|
MolPort-027-640-926 |
0.65 |
CCCCC[C@H](O)\C=C\[C@H]1[C@H](O)C[C@@H](O)[C@@H]1C\C=C/CCCC(O)=O
|
|
MolPort-039-138-913 |
0.65 |
CCCCC[C@H](O)\C=C\[C@H]1[C@H](O)C[C@H](O)[C@@H]1C\C=C/CCCCCC(O)=O
|
|
MolPort-027-640-931 |
0.65 |
CCCCC(C)(C)[C@H](O)\C=C\[C@H]1[C@H](O)C[C@@H](O)[C@@H]1C\C=C/CCCC(O)=O
|
|
MolPort-027-640-945 |
0.65 |
CCCCC[C@@H](O)\C=C\[C@H]1[C@H](O)C[C@H](O)[C@@H]1C\C=C/CCCC(O)=O
|
|
MolPort-039-138-973 |
0.65 |
CCCCC[C@H](O)\C=C\[C@H]1[C@H](O)C[C@@H](O)[C@@H]1C\C=C\CCCC(O)=O
|
|
MolPort-039-139-025 |
0.65 |
[K+].CCCCC(C)(C)[C@H](O)\C=C\[C@H]1[C@H](O)CC(=C)[C@@H]1C\C=C/CCCC([O-])=O
|
|
MolPort-027-640-934 |
0.65 |
CCCCC[C@H](O)\C=C\[C@H]1[C@@H](O)C[C@H](O)[C@@H]1C\C=C/CCCC(O)=O
|
|
MolPort-009-019-380 |
0.65 |
CCCCC[C@@H](O)\C=C\[C@@H]1[C@@H](O)C[C@@H](O)[C@H]1C\C=C/CCCC(O)=O
|
|
MolPort-019-936-820 |
0.65 |
COC(=O)[C@]1(C)CCC[C@]2(C)[C@@H]1CCC1=CC(=O)[C@@H](C1)CCC2=O
|
|
MolPort-016-580-913 |
0.65 |
CCCCC[C@H](O)\C=C\[C@H]1[C@H](O)C[C@H](O)[C@H]1C\C=C/CCCC(O)=O
|
|
MolPort-003-849-235 |
0.65 |
CCCC[C@](C)(O)C\C=C\[C@H]1[C@H](O)CC(=O)[C@@H]1CCCCCCC(=O)OC
|
|
MolPort-009-019-592 |
0.65 |
CCCCC(F)(F)[C@H](O)CC[C@H]1[C@H](O)C[C@H](O)[C@@H]1C\C=C/CCCC(O)=O
|
|
MolPort-004-964-596 |
0.65 |
CC(=O)\C=C\C1(O)C(C)=CC(=O)CC1(C)C
|
|
MolPort-005-940-967 |
0.65 |
CCCCC[C@H](O)\C=C\[C@H]1[C@H](O)C[C@H](O)[C@@H]1C\C=C/CCCC(O)=O
|
|
MolPort-046-763-157 |
0.65 |
CCCCC(C)(O)C\C=C\[C@H]1[C@@H](O)CC(=O)[C@H]1CCCCCCC(=O)OC
|
|
MolPort-039-138-844 |
0.65 |
CCCCC(C)(O)C\C=C\[C@H]1[C@@H](O)CC(=O)[C@@H]1CCCCCCC(=O)OC
|
|
MolPort-039-338-206 |
0.65 |
C[C@H](CC\C=C(\C)C(O)=O)[C@H]1CC[C@@]2(C)[C@@H]3CC[C@@H](C(C)=C)[C@@]4(CCC(O)=O)C[C@@]34CC[C@]12C
|
|
MolPort-001-757-202 |
0.65 |
COC(=O)C1CCC=CC1
|
|
MolPort-001-739-530 |
0.65 |
CCC\C=C/CC(N)CC(O)=O
|
|
MCULE-3614421214 |
0.65 |
C1(C=O)=C(C)CCC(C(C)C)C1=O
|
|
MCULE-7654868641 |
0.65 |
CC(C(C1(C(O)=O)CC=CC1)C)C
|
|
MCULE-7375184421 |
0.65 |
C/C(/C)=C/[C@]1([C@@](C(O)=O)(C1(C)C)[H])[H]
|
|
MCULE-7617211001 |
0.65 |
[C@H]1(C(=O)O)C([C@@H]1/C=C(\C)/C)(C)C
|
|
MCULE-3343421278 |
0.65 |
O=C1C=C(CC2CC=CCC2)CCC1
|
|
MCULE-9790788139 |
0.65 |
O=C1CC2C3CCC(C(C)CCCC(C)C)C3(C)CCC2C2(C)CCCC=C21
|
|
MCULE-5881773205 |
0.65 |
CC1CC(CC2CC=CCC2)=CC(=O)C1
|
|
MCULE-8903209433 |
0.65 |
C1C[C@]23C[C@@]42CC[C@]2(C)[C@]([C@@H](CCC(=C)C(C)C)C)([H])CC[C@@]2(C)[C@]4([H])CC[C@@]3([H])[C@@](C(=O)O)(C)[C@H]1O
|
|
MCULE-8950557153 |
0.65 |
C1(C)(C)[C@@H]2C[C@H]1C(=CC2=O)C
|
|
MCULE-7341595899 |
0.65 |
C1(CO)(CO)CC=C(CC1C)CC/C=C(\C)/C
|
|
MCULE-1142475318 |
0.65 |
C1(C)(C)C2CC1C(=CC2=O)C
|
|
MCULE-1285373407 |
0.65 |
C/C(=C/[C@H]1C(C)(C)[C@H]1C(=O)O)/C
|
|
MCULE-8974284912 |
0.65 |
CCC(C1(C(O)=O)CC=CC1)C
|
|
MCULE-7659859570 |
0.65 |
[C@]12(C)CC(C)=C(C[C@@]1([H])C(C(C(C)=O)C2=O)=O)C
|
|
MCULE-7918435177 |
0.65 |
C1(C)(C)[C@]2([H])C[C@@]1([H])C(C)=C[C@@H]2O
|
|
MCULE-1319324374 |
0.65 |
CC1CC=C(C(CC2CC=CC2)=O)CC1
|
|
MCULE-3836274754 |
0.65 |
C12CC(C=C1)C(CO)(CO)C2
|
|
MCULE-5776284238 |
0.65 |
C12CC(C=C1)C(CO)C2CO
|
|
MCULE-4506773274 |
0.65 |
C/C(/C)=C/C1C(C)(C)C1C(O)=O
|
|
MCULE-1556522580 |
0.65 |
C1(=O)CCC=CCCCCC1
|
|
MCULE-5459126693 |
0.65 |
O=C(C1C2CC(CC2)C1)CC1CC=CC1
|
|
MCULE-7818217503 |
0.65 |
C1CCC(=O)CCCC=1
|
|
MCULE-7704943892 |
0.65 |
C1(CC)CC(=O)CCCCC=C1
|
|
MCULE-2352400825 |
0.65 |
C12C(C(=O)OC)C(C(=O)OC)C(C(C(OC)=O)C1C(OC)=O)C=C2
|
|
MCULE-4172470592 |
0.65 |
C(C)(=O)OC1CCC2(C)C(C1)(C(C=C1C3CCC(C(C)C=CC(C)C(C)C)C3(C)CCC12[H])=O)[H]
|
|
MCULE-7713771264 |
0.65 |
[C@]12(C)C[C@@H]([C@H](O)[C@@](C)(C(=O)O)[C@]1([H])CC[C@@]1(C)C3CC[C@@]4(C(=O)O)CCC(C)(C)C[C@@]4([H])C=3[C@@H](CCl)C[C@]21[H])O
|
|
MCULE-4687201971 |
0.65 |
C1C[C@@]2(C)C3=CC[C@@]4(O)C(=C)C(=O)[C@@]3(C4)C[C@H](O)[C@]2([H])[C@](C)(C(=O)O)C1
|
|
MCULE-4976051850 |
0.65 |
[C@]12(C)C[C@@H]([C@H](O)[C@@](C)(C(=O)O)[C@]1([H])CC[C@@]1(C)C3CC[C@@]4(C(=O)O)CCC(C)(C)C[C@@]4([H])C=3[C@@H](CCl)C[C@]21[H])O
|
|
MCULE-6412555386 |
0.65 |
[C@@]12(C)CC[C@@]3(C)[C@@]4([H])OC(=O)[C@@](C4)(C)C[C@@]3([H])C1=CC[C@]1([H])[C@@]3(C)CC[C@H](O)C(C)(C)[C@]3([H])CC[C@@]21C
|
|
MCULE-8016431488 |
0.65 |
C1C[C@]2(C)[C@@]3([H])CC=C4[C@]5([H])C[C@@]6(C(=O)O[C@@]([H])(C6)[C@]5(C)CC[C@@]4(C)[C@]3(C)CC[C@@]2([H])C(C)(C)[C@H]1O)C
|
|
MCULE-3046367928 |
0.65 |
C1=CC2C3C4C5C(C(OC)=O)(C2(C(OC)=O)C4C=C5)C13
|
|
MCULE-6674928970 |
0.65 |
C12C3[C@](C)(CC[C@](C)(C(OC)=O)C3)CC[C@@]1(C)[C@]1(C(C(=O)C=2)[C@@]2(C)C[C@H](Br)C(C(C)(C)C2CC1)=O)C
|
|
MCULE-1018439007 |
0.65 |
C[C@]12CC[C@@]3([H])[C@](CCC4[C@]3(C)CCC(=O)C=4Cl)([H])[C@]1([H])CC[C@@H]2O
|
|
MCULE-7547377444 |
0.65 |
[C@]12(C)CC[C@@]3([C@@]([H])(CCC4=CC(=O)CC[C@]34C)C1CC(Br)[C@]2(O)C(C)=O)[H]
|
|
MCULE-8305742317 |
0.65 |
CCC12C(C#C)(O)CCC1C1CCC3C(C1C(=C)C2)CCC(=O)C=3
|
|
MCULE-9454333017 |
0.65 |
[C@]12(C)CCC(C(Cl)=C1CCC1C2CC[C@]2(C1CC[C@]2(C)O)C)=O
|
|
MCULE-2054566768 |
0.65 |
[C@@]12(C)CC[C@]3(CCC(C)(C)C[C@@]3([H])C1=CC[C@]1([H])[C@@]3([C@]([H])(C(C)(C)[C@H](CC3)OC(C)=O)CC[C@@]21C)C)C(O)=O
|
|
MCULE-3362275267 |
0.65 |
C1CC=CC2C(C(OCC)=O)C2CC1
|
|
MCULE-2260551226 |
0.65 |
C1(C(OC)=O)CC(C)=C(CC1C(OC)=O)C
|
|
MCULE-5998876996 |
0.65 |
O(C(C)=O)[C@H]1CC[C@@]2(C)[C@H](C1(C)C)CC[C@@]1(C)[C@]3(C)CC[C@@]4(C(=O)O)CCC(C)(C)C[C@H]4C3=CC[C@@H]12
|
|
MCULE-7933835085 |
0.65 |
[C@@]12(C)[C@](O)(CCC1C1C(C(O)C2)[C@@]2(C)CCC(C=C2CC1)=O)C#N
|
|
MCULE-4168657248 |
0.65 |
[C@H]1(CCC(=O)CCCCCCC)[C@H](O)C[C@H](O)[C@@H]1C/C=C\CCCC(=O)OC(C)C
|
|
MCULE-2403352810 |
0.65 |
C12=CC[C@]3([H])[C@@]4(C)CC[C@H](OC(C)=O)C(C)(C)[C@@]4(CC[C@@]3(C)[C@]1(C)CC[C@]1(CC[C@@H](C)[C@H](C)[C@@]21[H])C(O)=O)[H]
|
|
MCULE-6805519453 |
0.65 |
[C@]12(C)CCC(C(Cl)=C1CCC1C2CC[C@]2(C1CCC2O)C)=O
|
|
MCULE-4339982355 |
0.65 |
CC[C@@]12[C@](O)(C#C)CC[C@H]1[C@@H]1CCC3[C@@H]([C@H]1C(=C)C2)CCC(=O)C=3
|
|
MCULE-1658645050 |
0.65 |
C1CC2=CC([C@](O)(C[C@]2(C)[C@H]([C@@H]1O)C)C(=C)C)=O
|
|
MCULE-1900386533 |
0.65 |
C1[C@]2([H])[C@@]3([H])C(=C)C[C@@]4(CC)[C@@]([H])(CC[C@]4(C#C)O)[C@]3([H])CCC2=CC(=O)C1
|
|
MCULE-8107340389 |
0.65 |
C12CC(=O)C(C)=C1CC(C(C(=O)O)=C)C(O)CC2C
|
|
MCULE-9033140847 |
0.65 |
[C@@]12(C)[C@](O)(CCC1C1C(C(=O)C2)[C@@]2(C)CCC(C=C2CC1)=O)C#N
|
|
MCULE-4484854858 |
0.65 |
OC(C1(CC=CCC1)CC#N)=O
|
|
MCULE-7818588594 |
0.65 |
CCCCCC[C@@](O)(CC=CCCCCCCCC(OCC)=O)[H]
|
|
MCULE-9234552398 |
0.65 |
C1/C(/C(CC[C@@H]1O)=C)=C/C=C1\CCC[C@]2(C)[C@@H]([C@@H](CC(=O)O)C)CC[C@]2\1[H]
|
|
MCULE-1124335251 |
0.65 |
C(OC(=O)CCCCCCCC=CCCCCCCCC)CCCCCCCCC
|
|
MCULE-5174909262 |
0.65 |
C(CCCCCCCC=CCCCCCCCC)(OCCCC)=O
|
|
MCULE-5670150971 |
0.65 |
C(/C=C\CC)C(C(O)/C=C/C(O)CCCCCCCC(=O)O)O
|
|
MCULE-7588379835 |
0.65 |
C1CC(C2C(O)CC(C)=CC(=O)C21C)(O)C(C)C
|
|
MCULE-1401500807 |
0.65 |
O=C1C(CC2CC=CCC2)COCC1
|
|
MCULE-4789514903 |
0.65 |
CC(C1(C(O)=O)CC=CCC1)C#N
|
|
MCULE-2997418374 |
0.65 |
C(OCC(CC)CCCC)(=O)CCCCCCCC=CCCCCCCCC
|
|
MCULE-1875219399 |
0.65 |
C1/C(/C(CC[C@@H]1O)=C)=C/C=C1/[C@]2([H])CC[C@H]([C@@H](C(=O)O)C)[C@@]2(C)CCC/1
|
|
MCULE-3541447914 |
0.65 |
C(=O)(OCCCCCCCCCCCC)CCCCCCCC=CCCCCCCCC
|
|
MCULE-9430504051 |
0.65 |
C123CCC=CCCC1(C(C(=O)C2C(OC)=O)C(OC)=O)C(C(=O)C3C(OC)=O)C(OC)=O
|
|
MCULE-4463064740 |
0.65 |
C(OCC)(C1CC2CC1C=C2)=O
|
|
MCULE-9383833777 |
0.65 |
C1(O)CC2(C(O)(CO)C(=CC(C2C(C)(C1)C)=O)C)C
|
|
MCULE-5241313012 |
0.65 |
C12(C)CCC(C=C1CCC1C2CCC2(C1CCC2OC(C)=O)C)=O
|
|
MCULE-1850569909 |
0.65 |
[C@]12(C)CCC3[C@@]([H])(CCC4=CC(=O)CCC43)C1CC[C@@H]2OC(C)=O
|
|
MCULE-3280168913 |
0.65 |
C1C(C(CCC=1C)CC(OCC)=O)O
|
|
MCULE-9340600776 |
0.65 |
C1C(C(CCC=1C)CC(=O)OCC)=O
|
|
MCULE-9650544498 |
0.65 |
[C@]12([H])CC[C@]3(C)[C@H](CC[C@@]3([H])[C@]1([H])CCC1=CC(=O)CC[C@]21C)OC(=O)C
|
|
MCULE-3172312748 |
0.65 |
C1C2(CCC2(CC=C1)C(OC)=O)C(OC)=O
|
|
MCULE-3173207342 |
0.65 |
C(O[C@@H]1[C@]2(C)[C@H]([C@H]3[C@H](CC2)[C@]2(C)C(=CC(=O)CC2)CC3)CC1)(=O)C
|
|
MCULE-4587868817 |
0.65 |
CC1(C(=O)CC[C@@]2(C)C1CC(C1[C@@]3(C)[C@]([C@@H]([C@@H](C[C@@H](/C=C(/C(=O)O)\C)O)C)CC3=O)(C)CC(=O)C=12)=O)C
|
|
MCULE-8723675857 |
0.65 |
[C@]12(C)CCC3[C@@]([H])(CC=C4C[C@@H](OC=O)CC[C@]34C)C1CC[C@]2(O)C(C)=O
|
|
MCULE-6020138869 |
0.65 |
C1C2CC(CC2C(=O)OC(C)(C)C)C=1
|
|
MCULE-3758685184 |
0.65 |
O(C(C)=O)[C@H]1CC[C@@H]2[C@]1(C)CC[C@@H]1[C@@]3(C)C(C)=CC(C[C@@H]3CC[C@@H]21)=O
|
|
MCULE-6913740702 |
0.65 |
O=C1CCC2(C)C3CCC4(C)C(CCC4C3CCC2=C1)C(C)([H])OC(C)=O
|
|
MCULE-2766753223 |
0.65 |
C(=O)(OC(C)C)C1CC2CC1C=C2
|
|
MCULE-9320911552 |
0.65 |
CCC(C(O)C(C(=O)C(C)/C=C(/CC(C(C(C(=O)OC)C)O)C)\C)C)C
|
|
MCULE-4576776987 |
0.65 |
C1(C2C3C4CC4(C4CCC(=C4CC3(CO)CCC2(C(C1)O)C)C(O)=O)C)C(C)C
|
|
MCULE-4184427131 |
0.65 |
C1C(C)(C)C(O)(/C=C/C(=O)C)C(C)=CC1=O
|
|
MCULE-7840184850 |
0.65 |
CC1C(C(CC2CC=CCC2)=O)CCO1
|
|
MCULE-2841725041 |
0.65 |
O=C(C1C2C1COC2)CC1CC=CCC1
|
|
MCULE-6283271359 |
0.65 |
[C@H]1(CCCCCCC(=O)OC)C(=O)C[C@@H](O)[C@@H]1C=CC[C@@](C)(O)CCCC
|
|
MCULE-5302779679 |
0.65 |
CC1OCC(C(CC2CC=CCC2)=O)C1
|
|
MCULE-1531956184 |
0.65 |
C12C[C@@]([H])(CCC([C@]3([C@](CC1)([C@](C)(C(OC)=O)CCC3)[H])C)=O)C(=O)C=2
|
|
MCULE-3985606919 |
0.65 |
[C@]12(CCC(=O)O)C[C@@]31CC[C@]1(C)[C@@]([H])([C@@H](CC/C=C(\C(=O)O)/C)C)CC[C@@]1(C)[C@]3([H])CC[C@@]2([H])C(=C)C
|
|
MCULE-6086633267 |
0.65 |
C12(CCC(C(C)(C)C1=C)(C(O)=O)C2)C(O)=O
|
|
MCULE-3969146797 |
0.65 |
C1(=C)C2CCC1CC(C(OC)=O)C2
|
|
MCULE-9494795833 |
0.65 |
C(/CC(N)CC(=O)O)=C/CCC
|
|
MCULE-2216758301 |
0.65 |
C1(C)(C)C2([H])C(O)C=C(C)C1(C2)[H]
|
|
MolPort-019-992-002 |
0.65 |
O=C1CCC2(CCCC2)C=C1
|
|
MolPort-046-067-628 |
0.65 |
O[C@H]1C2CCC[C@H]1C1=C(CCCC1)C2
|
|
MolPort-003-664-628 |
0.65 |
OCC1C2CC(C=C2)C1CO
|
|
MolPort-038-386-020 |
0.65 |
CC(CC(=O)C=C(C)C)C1CCC(C)=CC1=O
|
|
MolPort-046-509-819 |
0.65 |
O=C1CC=CCC11CCCCC1
|
|
MolPort-046-067-683 |
0.65 |
O=C1C2CCC[C@H]1C1=C(CCCC1)C2
|
|
MolPort-044-832-300 |
0.65 |
CC1(C)[C@@H]2C[C@H]1C(=O)C=C2
|
|
MolPort-003-928-511 |
0.65 |
CC1=C[C@H](O)C2CC1C2(C)C
|
|
MolPort-046-790-506 |
0.65 |
CC(=O)CCC[C@]1(C)CC[C@H](CC1=O)C(=C)C(O)=O
|
|
MolPort-000-706-765 |
0.65 |
CC1=CC(=O)C2CC1C2(C)C
|
|
MolPort-003-926-713 |
0.65 |
OCC1(CO)CC2CC1C=C2
|
|
MolPort-006-109-385 |
0.65 |
CC(C)=C[C@H]1[C@@H](C(O)=O)C1(C)C
|
|
MolPort-028-754-122 |
0.65 |
CC(C)C(=C)CC[C@@H](C)[C@H]1CC[C@@]2(C)[C@@H]3CC[C@@H]4[C@]5(C[C@@]35CC[C@]12C)CC[C@H](O)[C@@]4(C)C(O)=O
|
|
MolPort-029-945-688 |
0.65 |
CC1=C[C@H](O)[C@H]2C[C@@H]1C2(C)C
|
|
MolPort-001-785-569 |
0.65 |
CC(C)=CC1C(C(O)=O)C1(C)C
|
|
MolPort-002-558-775 |
0.65 |
CC(=O)C1C(=O)[C@@H]2CC(C)=C(C)C[C@]2(C)C1=O
|
|
MolPort-046-067-712 |
0.65 |
CC1CC(CCC=C(C)C)=CCC1(CO)CO
|
|
MolPort-000-146-079 |
0.65 |
CC1=CC(=O)[C@H]2C[C@@H]1C2(C)C
|
|
MolPort-046-774-258 |
0.65 |
O=C1CCC2(CCCCCC2)C=C1
|
|
MolPort-046-647-234 |
0.65 |
O=C1C2CCCC1C=CC2
|
|
MolPort-003-922-566 |
0.65 |
O=C1CCCCC\C=C/CC1
|
|
MolPort-029-001-358 |
0.65 |
CC(=O)C1CCC=CC1
|
|
MolPort-006-116-093 |
0.65 |
OC1CCC\C=C/CC1
|
|
MolPort-044-195-003 |
0.65 |
O[C@H]1CCC\C=C/CC1
|
|
MolPort-028-750-814 |
0.65 |
OC1CCCC=CCC1
|
|
MolPort-001-782-919 |
0.65 |
OCCC1CCCC=C1
|
|
MolPort-000-765-633 |
0.65 |
COC(=O)[C@@]1(C)CC[C@]2(C)CC[C@]3(C)C(=CC(=O)C4[C@@]5(C)C[C@H](Br)C(=O)C(C)(C)C5CC[C@@]34C)C2C1
|
|
MolPort-020-005-767 |
0.65 |
CC1(C)CC[C@@]2(CCC3=C([C@@H](CCl)C[C@@H]4[C@@]5(C)C[C@H](O)[C@H](O)[C@](C)([C@@H]5CC[C@@]34C)C(O)=O)[C@@H]2C1)C(O)=O
|
|
MolPort-039-339-050 |
0.65 |
CC(CC(=O)C[C@](C)(O)[C@H]1CC(=O)[C@@]2(C)C3=C(C(=O)C[C@]12C)[C@@]1(C)CC[C@H](O)C(C)(C)C1C[C@@H]3O)C(O)=O
|
|
MolPort-042-624-491 |
0.65 |
C[C@]12CC(=O)C3=C([C@@H](O)CC4C(C)(C)C(=O)CC[C@]34C)[C@]1(C)C(=O)C[C@@H]2C(=C)CCC(O)=O
|
|
MolPort-020-005-756 |
0.65 |
C[C@]12C[C@H](OC1=O)[C@]1(C)CC[C@]3(C)C(=CC[C@@H]4[C@@]5(C)CC[C@H](O)C(C)(C)[C@@H]5CC[C@@]34C)[C@@H]1C2
|
|
MolPort-046-153-765 |
0.65 |
CC(CC(=O)C[C@](C)(O)[C@H]1C[C@H](O)[C@@]2(C)C3=C(C(=O)C[C@]12C)[C@@]1(C)CC[C@H](O)C(C)(C)C1C[C@@H]3O)C(O)=O
|
|
MolPort-039-338-223 |
0.65 |
C[C@]1(CCC[C@]2(C)[C@@H]1[C@@H](O)C[C@@]13C[C@@](O)(CC=C21)C(=C)C3=O)C(O)=O
|
|
MolPort-035-706-526 |
0.65 |
CC(=O)O[C@H]1CC[C@@]2(C)[C@@H](CC[C@]3(C)[C@@H]2CC=C2[C@@H]4C[C@@]5(C)C[C@H](OC5=O)[C@]4(C)CC[C@@]32C)C1(C)C
|
|
MolPort-046-590-046 |
0.65 |
CC1(C)CC[C@@]2(CCC3=C([C@@H](CCl)C[C@@H]4[C@@]5(C)C[C@H](O)[C@H](O)[C@@](C)(C5CC[C@@]34C)C(O)=O)[C@H]2C1)C(O)=O
|
|
MolPort-019-990-913 |
0.65 |
CCCCCCCC(=O)CC[C@H]1[C@H](O)C[C@H](O)[C@@H]1C\C=C\CCCC(=O)OC(C)C
|
|
MolPort-002-510-852 |
0.65 |
CC(=O)[C@@]1(O)C(Br)CC2C3CCC4=CC(=O)CC[C@]4(C)C3CC[C@]12C
|
|
MolPort-046-765-287 |
0.65 |
[2H]C#C[C@]1(O)CC[C@H]2[C@@H]3CC([2H])([2H])C4=C([2H])C(=O)C([2H])([2H])C[C@]4([2H])[C@H]3C(=C)C[C@]12CC
|
|
MolPort-003-847-336 |
0.65 |
CC[C@]12CC(=C)[C@H]3[C@@H](CCC4=CC(=O)CC[C@H]34)[C@@H]1CC[C@@]2(O)C#C
|
|
MolPort-001-740-023 |
0.65 |
C[C@H]1[C@H](O)CCC2=CC(=O)[C@](O)(C[C@]12C)C(C)=C
|
|
MolPort-002-855-106 |
0.65 |
COC(=O)[C@H]1CC(C)=C(C)C[C@H]1C(=O)OC
|
|
MolPort-002-855-142 |
0.65 |
COC(=O)[C@@H]1CC(C)=C(C)C[C@H]1C(=O)OC
|
|
MolPort-039-052-417 |
0.65 |
C[C@@H]1CC[C@@]2(CC[C@]3(C)C(=CC[C@@H]4[C@@]5(C)CC[C@H](OC(C)=O)C(C)(C)[C@@H]5CC[C@@]34C)[C@@H]2[C@H]1C)C(O)=O
|
|
MolPort-046-766-230 |
0.65 |
C[C@]12C[C@@H](O)[C@@H]3[C@@H](C[C@H](O)C4=CC(=O)CC[C@]34C)[C@H]1CC[C@@]2(O)C(=O)CO
|
|
MolPort-027-640-891 |
0.65 |
CC\C=C/C[C@H](O)\C=C\[C@H]1[C@H](O)CC(=O)[C@@H]1C\C=C/CCCC(O)=O
|
|
MolPort-046-764-998 |
0.65 |
C[C@]12C[C@H](O)[C@@H]3[C@H](C[C@H](O)C4=CC(=O)CC[C@]34C)[C@@H]1CC[C@]2(O)C(=O)CO
|
|
MolPort-046-689-207 |
0.65 |
[Na+].C[C@@H]1C(O)CC[C@@]2(C)[C@H]1CC[C@@]1(C)[C@H]2C(O)C[C@H]2\C([C@@H](O)C[C@]12C)=C(\CCC=C(C)C)C([O-])=O
|
|
MolPort-002-510-943 |
0.65 |
C[C@]12CC(=O)C3C(CCC4=CC(=O)CC[C@]34C)C1CC[C@]2(O)C#N
|
|
MolPort-003-941-707 |
0.65 |
C[C@]12C[C@H](O)[C@H]3[C@@H](C[C@H](O)C4=CC(=O)CC[C@]34C)[C@@H]1CC[C@]2(O)C(=O)CO
|
|
MolPort-003-850-810 |
0.65 |
CCCCCCCC(=O)CC[C@H]1[C@H](O)C[C@H](O)[C@@H]1C\C=C/CCCC(=O)OC(C)C
|
|
MolPort-046-690-013 |
0.65 |
[2H]C1([2H])[C@]([2H])(O)[C@@]2([2H])[C@@H](C[C@@H](O)C3=CC(=O)CC[C@]23C)[C@@H]2CC[C@](O)(C(=O)CO)[C@@]12C
|
|
MolPort-021-804-571 |
0.65 |
CC1CC(O)C(CC2=C(C)C(=O)CC12)C(=C)C(O)=O
|
|
MolPort-027-640-939 |
0.65 |
CCCCCC(=O)CC[C@H]1[C@H](O)C[C@H](O)[C@@H]1C\C=C/CCCC(=O)OC(C)C
|
|
MolPort-046-693-056 |
0.65 |
C[C@]1(O)CC[C@H]2[C@@H]3CCC4=C(Cl)C(=O)CC[C@]4(C)[C@H]3CC[C@]12C
|
|
MolPort-046-765-463 |
0.65 |
CC[C@]12CC[C@H]3[C@@H](C[C@@H](O)C4=CC(=O)CC[C@H]34)[C@@H]1CCC2(O)C#C
|
|
MolPort-035-683-171 |
0.65 |
CC(=O)O[C@H]1CC[C@@]2(C)[C@@H](CC[C@]3(C)[C@@H]2CC=C2[C@@H]4CC(C)(C)CC[C@@]4(CC[C@@]32C)C(O)=O)C1(C)C
|
|
MolPort-046-790-502 |
0.65 |
C[C@@H]1CC[C@@]2(CC[C@]3(C)C(=CC[C@@H]4[C@@]5(C)CC[C@H](O)C(C)(C)[C@@H]5CC[C@@]34C)C2=C1C)C(O)=O
|
|
MolPort-046-690-024 |
0.65 |
CC[C@@]12CC[C@H]3[C@@H](C[C@@H](O)C4=CC(=O)CC[C@H]34)[C@@H]1CC[C@@]2(O)C#C
|
|
MolPort-002-511-517 |
0.65 |
C[C@]1(O)CCC2C3CCC4=C(Cl)C(=O)CC[C@]4(C)C3CC[C@]12C
|
|
MolPort-002-511-183 |
0.65 |
C[C@]12CC(O)C3C(CCC4=CC(=O)CC[C@]34C)C1CC[C@]2(O)C#N
|
|
MolPort-046-702-539 |
0.65 |
C[C@]12C[C@H](O)[C@H]3[C@@H](CC(O)C4=CC(=O)CC[C@]34C)[C@@H]1CC[C@]2(O)C(=O)CO
|
|
MolPort-046-792-919 |
0.65 |
CC1=C2CC[C@H]3[C@H]4CCC(C)(O)[C@@]4(C)CC[C@H]3[C@@]2(C)C\C(=C/O)C1=O
|
|
MolPort-039-343-842 |
0.65 |
CCC12CC(=C)C3C(CCC4=CC(=O)CCC34)C1CCC2(O)C#C
|
|
MolPort-044-830-290 |
0.65 |
C[C@]12CC[C@H]3[C@@H](C[C@@H](O)C4=CC(=O)CC[C@H]34)[C@@H]1CC[C@@]2(O)C#C
|
|
MolPort-044-649-702 |
0.65 |
CC1(C)CC[C@@]2(CC[C@]3(C)C(=CC[C@@H]4[C@@]5(C)CC\C(=N/O)C(C)(C)[C@@H]5CC[C@@]34C)[C@@H]2C1)C(O)=O
|
|
MolPort-035-683-186 |
0.65 |
C[C@@H]1CC[C@@]2(CC[C@]3(C)C(=CC[C@@H]4[C@@]5(C)CC[C@H](OC(C)=O)C(C)(C)C5CC[C@@]34C)[C@@H]2[C@H]1C)C(O)=O
|
|
MolPort-002-507-453 |
0.65 |
CC(=O)[C@@]1(O)C(Br)CC2[C@@H]3CCC4=CC(=O)CC[C@]4(C)[C@@H]3CC[C@]12C
|
|
MolPort-046-793-309 |
0.65 |
CCCCCCCCCCOC(=O)CCCCCCC\C=C\CCCCCCCC
|
|
MolPort-002-801-701 |
0.65 |
COC(=O)C1C(=O)C(C(=O)OC)C23CC\C=C/CCC12C(C(=O)OC)C(=O)C3C(=O)OC
|
|
MolPort-044-561-392 |
0.65 |
CCCCCC\C=C/CCCCCCCC(=O)OC(CCCCCC)CCCCCCCCCCC(O)=O
|
|
MolPort-038-386-640 |
0.65 |
CC\C=C/CC(O)\C=C\C(=O)CCCCCCCCC(O)=O
|
|
MolPort-046-793-308 |
0.65 |
CCCCCCCOC(=O)CCCCCCC\C=C/CCCCCC
|
|
MolPort-044-561-394 |
0.65 |
CCCCCC\C=C/CCCCCCCC(=O)OC(CCCCC)CCCCCCCCCCCC(O)=O
|
|
MolPort-009-018-291 |
0.65 |
CCCCCC(O)\C=C\[C@@H]1C(CCCCCCCO)C(O)CC1=O
|
|
MolPort-044-561-662 |
0.65 |
CCCCCCCCC(CCCCCCCCC(O)=O)OC(=O)CCCCCCC\C=C/CCCCCC
|
|
MolPort-044-561-383 |
0.65 |
CCCCCCCCCC(CCCCCCCC(O)=O)OC(=O)CCCCCCC\C=C/CCCCCC
|
|
MolPort-006-124-971 |
0.65 |
CCCCCCCC\C=C/CCCCCCCC(=O)OCC(CC)CCCC
|
|
MolPort-039-138-833 |
0.65 |
CCCCC[C@H](O)\C=C\[C@H]1[C@H](O)CC(=O)[C@@H]1CCCCCCCO
|
|
MolPort-044-183-360 |
0.65 |
CCCCCCCC\C=C/CCCCCCCC(=O)OC(CCCCCC)CCCCCCCCCCC(O)=O
|
|
MolPort-046-692-934 |
0.65 |
C[C@]12CC[C@H]3[C@@H](CCC4=CC(=O)C=C[C@]34C)[C@@H]1CC[C@]2(O)C(=O)CO
|
|
MolPort-006-127-334 |
0.65 |
CCCCCCCCCCCCOC(=O)CCCCCCC\C=C/CCCCCCCC
|
|
MolPort-001-740-402 |
0.65 |
CC\C=C/CC(O)C(O)\C=C\C(O)CCCCCCCC(O)=O
|
|
MolPort-006-115-611 |
0.65 |
CCCCCCCCCCOC(=O)CCCCCCC\C=C/CCCCCCCC
|
|
MolPort-044-183-372 |
0.65 |
[2H]C([2H])([2H])C([2H])([2H])C([2H])([2H])C([2H])([2H])C([2H])([2H])C([2H])([2H])C([2H])([2H])C([2H])([2H])\C=C/CCCCCCCC(=O)OC(CCCCCC)CCCCCCCCCCC(O)=O
|
|
MolPort-046-702-733 |
0.65 |
CCCC[Sn++]CCCC.CCCCCCCC\C=C/CCCCCCCC([O-])=O.CCCCCCCC\C=C/CCCCCCCC([O-])=O
|
|
MolPort-044-183-353 |
0.65 |
CCCCCCCCCC(CCCCCCCC(O)=O)OC(=O)CCCCCCC\C=C/CCCCCCCC
|
|
MolPort-003-959-446 |
0.65 |
CCCCCC[C@@H](O)C\C=C/CCCCCCCC(=O)OCC
|
|
MolPort-044-183-363 |
0.65 |
CCCCCCCC\C=C/CCCCCCCC(=O)OC(CCCCC)CCCCCCCCCCCC(O)=O
|
|
MolPort-044-561-663 |
0.65 |
CCCCCCCC\C=C/CCCCCCCC(=O)OC(CCCCCCCC)CCCCCCCCC(O)=O
|
|
MolPort-044-852-250 |
0.65 |
OC(=O)C1(CC#C)CCC=CC1
|
|
MolPort-001-783-805 |
0.65 |
CCCCCCCC\C=C/CCCCCCCC(=O)OCCCC
|
|
MolPort-046-788-529 |
0.64 |
CC(=O)\C=C\C=C\CCCCCCC(O)=O
|
|
MolPort-038-386-725 |
0.64 |
CCC\C=C\C=C\C(CCC(O)=O)CC(O)=O
|
|
MolPort-001-740-393 |
0.64 |
CCCCC\C=C\C=C\C(O)CCCCCCCC(O)=O
|
|
MolPort-005-945-729 |
0.64 |
CC(C)=C1CC2C(CCC2(C)O)C(C)(O)CC1=O
|
|
MolPort-044-561-076 |
0.64 |
CCCCC\C=C\C=C\C(=O)CCCCCCCC(O)=O
|
|
MolPort-006-668-454 |
0.64 |
CCCCCC(=O)\C=C\C=C/CCCCCCCC(O)=O
|
|
MolPort-005-944-603 |
0.64 |
CCCCCC\C=C/C=C/C(O)CCCCCCC(O)=O
|
|
MolPort-039-338-593 |
0.64 |
CC(C)=C1C[C@H]2[C@@H](CC[C@]2(C)O)[C@](C)(O)CC1=O
|
|
MolPort-002-706-878 |
0.64 |
CC(=O)C12CC(C)=C(C)CC1CC1C3CCC4=CC(=O)CCC4(C)C3CCC21C
|
|
MolPort-046-594-334 |
0.64 |
CC1(CO)CC(O)CC2(C)C3CCC(C)(C=C3CCC12)C(O)CO
|
|
MolPort-020-005-644 |
0.64 |
C[C@@]1(CO)C[C@@H](O)C[C@@]2(C)[C@@H]3CC[C@@](C)(C=C3CC[C@H]12)[C@@H](O)CO
|
|
MolPort-039-339-018 |
0.64 |
C[C@H](CC[C@@H](O)C(C)(C)O)[C@H]1CC[C@@]2(C)[C@@H]3CC=C4[C@@H](CC[C@H](O)C4(C)C)[C@]3(C)[C@H](O)C[C@]12C
|
|
MolPort-028-599-903 |
0.64 |
C[C@H](C\C=C\C(C)(C)O)[C@H]1CC[C@@]2(C)[C@@H]3CC[C@@H]4[C@]5(C[C@@]35CC[C@]12C)CCC(=O)C4(C)C
|
|
MolPort-039-339-170 |
0.64 |
C[C@@]1(CO)CC[C@]2(C)CC[C@]3(C)C4=CC[C@H]5C(C)(C)[C@H](O)CC[C@]5(C)C4=CC[C@@]3(C)[C@@H]2C1
|
|
MolPort-029-943-149 |
0.64 |
CC1=CCC2C(C)(CO)CCCC2(CO)C1CO
|
|
MolPort-035-706-292 |
0.64 |
CC[C@@H](\C=C\[C@@H](C)[C@H]1CC[C@H]2[C@@H]3CC=C4C[C@@H](O)CC[C@]4(C)[C@H]3CC[C@]12C)C(C)=C
|
|
MolPort-046-765-408 |
0.64 |
C[C@]12CC[C@@H]3[C@@H]([C@H]4C[C@H]4C4=CC(=O)CC[C@]34C)[C@H]1[C@@H]1C[C@@H]1C2=O
|
|
MolPort-003-850-422 |
0.64 |
CCCCCCCCCCC(=O)O[C@H]1CC[C@H]2[C@@H]3CCC4=CC(=O)CC[C@]4(C)[C@H]3CC[C@]12C
|
|
MolPort-042-652-640 |
0.64 |
CC12CCC3C(CCC4=CC(=O)CCC34C)C1CCC2OC(=O)CCC1CCCC1
|
|
MolPort-003-959-766 |
0.64 |
CC(C)CCC(=O)O[C@H]1CC[C@H]2[C@@H]3CCC4=CC(=O)CC[C@]4(C)[C@H]3CC[C@]12C
|
|
MolPort-046-033-731 |
0.64 |
COC(=O)[C@@H]1C2CC(C=C2)[C@H]1C(O)=O
|
|
MolPort-003-959-707 |
0.64 |
CCCCCCC(=O)O[C@H]1CC[C@H]2[C@@H]3CCC4=CC(=O)CC[C@]4(C)[C@H]3CC[C@]12C
|
|
MolPort-003-959-637 |
0.64 |
C[C@]12CC[C@H]3[C@@H](CCC4=CC(=O)CC[C@]34C)[C@@H]1CC[C@@H]2OC(=O)CCC1CCCC1
|
|
MolPort-046-418-951 |
0.64 |
CC1(C)[C@H](CC[C@@]2(C)[C@H]1CC[C@]1(C)C2=CC[C@@H]2[C@@H]3C[C@](C)(CC[C@]3(C)CC[C@@]12C)C(O)=O)OC(=O)CCC(O)=O
|
|
MolPort-006-111-246 |
0.64 |
CCCCCCCCCC(=O)O[C@H]1CC[C@H]2[C@@H]3CCC4=CC(=O)CC[C@@H]4[C@H]3CC[C@]12C
|
|
MolPort-019-995-532 |
0.64 |
CCCCCCC(=O)O[C@H]1CC[C@H]2[C@@H]3CC[C@H]4CC(=O)C=C(C)[C@]4(C)[C@H]3CC[C@]12C
|
|
MolPort-002-526-405 |
0.64 |
CC(C)(O)CC[C@H](O)[C@](C)(O)[C@H]1CC[C@@]2(O)C3=CC(=O)[C@@H]4C[C@@H](O)[C@@H](O)C[C@]4(C)C3[C@H](O)C[C@]12C
|
|
MolPort-039-141-776 |
0.64 |
CC(C)CC[C@@H](O)[C@](C)(O)[C@H]1CC[C@@]2(O)C3=CC(=O)[C@@H]4C[C@@H](O)[C@@H](O)C[C@]4(C)[C@H]3[C@H](O)C[C@]12C
|
|
MolPort-002-510-055 |
0.64 |
C[C@]12CC[C@@]3(O)C(CCC4=CC(=O)CC[C@]34C)C1CC[C@]2(O)C#N
|
|
MolPort-000-732-301 |
0.64 |
CC(C)(O)CC[C@H](O)C(C)(O)C1CC[C@@]2(O)C3=CC(=O)C4CC(O)C(O)CC4(C)C3[C@H](O)CC12C
|
|
MolPort-044-649-600 |
0.64 |
COC(=O)[C@]12CC[C@@H](C)[C@H](C)[C@H]1C1=CC(=O)[C@@H]3[C@@]4(C)C\C(=C\O)C(=O)C(C)(C)[C@@H]4CC[C@@]3(C)[C@]1(C)CC2
|
|
MolPort-002-507-402 |
0.64 |
CC(C)CCC(=O)OC1CCC2C3CCC4=CC(=O)CC[C@]4(C)C3CC[C@]12C
|
|
MolPort-039-141-359 |
0.64 |
CC(C)(O)CC[C@@H](O)[C@](C)(O)[C@H]1CC[C@@]2(O)C3=CC(=O)[C@@H]4C[C@@H](O)[C@@H](O)C[C@]4(C)[C@H]3[C@H](O)C[C@]12C
|
|
MolPort-019-992-388 |
0.64 |
CC(C)CCC(=O)OC1CCC2C3CCC4=CC(=O)CCC4(C)C3CCC12C
|
|
MolPort-046-793-259 |
0.64 |
CCC(=O)O[C@H]1CC[C@@H]2[C@H]3CCC4=CC(=O)CC[C@@H]4[C@@H]3CC[C@]12C
|
|
MolPort-002-501-818 |
0.64 |
COC(=O)C1C2CC(C=C2)C1C(=O)OC
|
|
MolPort-000-726-176 |
0.64 |
CCCCCCCCCC(=O)OC1CCC2C3CCC4=CC(=O)CCC4(C)C3CCC12C
|
|
MolPort-003-930-735 |
0.64 |
COC(=O)C1C2CC(C=C2)C1C(O)=O
|
|
MolPort-002-498-111 |
0.64 |
CC1=CC(O)CC(C)(C)C1
|
|
MolPort-001-794-308 |
0.64 |
CC1=C(C=O)C(C)(C)CCC1
|
|
MolPort-001-790-844 |
0.64 |
CC1(C)[C@@H]2C[C@H]1C(CCO)=CC2
|
|
MolPort-019-930-612 |
0.64 |
CC1(C)[C@H]2CC1C(CCO)=CC2
|
|
MolPort-023-220-735 |
0.64 |
CC(C)[C@H]1CC(=O)[C@@H](C)CC\C=C(C)\CC1=O
|
|
MolPort-001-781-500 |
0.64 |
CC1CC(C)=CC(=O)C1
|
|
MolPort-000-722-317 |
0.64 |
CCCCCC\C=C1/CCCCC1=O
|
|
MolPort-006-111-488 |
0.64 |
CC(C)C1CCC(=O)C=C1
|
|
MolPort-027-949-819 |
0.64 |
CCC1(CC)CCC(=O)C=C1
|
|
MolPort-046-153-062 |
0.64 |
C\C1=C\CCC(=C)C(O)CC2(C)CCC(C2CC1)C(C)(C)O
|
|
MolPort-001-817-194 |
0.64 |
CCCCC(CC)\C=C1/CCCCC1=O
|
|
MolPort-003-930-540 |
0.64 |
CC1(C)C2CC1C(CCO)=CC2
|
|
MolPort-003-931-189 |
0.64 |
CC1=CC(C)(C)CCC1=O
|
|
MolPort-000-701-433 |
0.64 |
CC1=CC(=O)CC(C)(C)C1
|
|
MolPort-039-101-217 |
0.64 |
CC1CC\C=C(C)\CCC(\C=C\1)C(C)(C)O
|
|
MolPort-000-811-412 |
0.64 |
CCCCC(CC)\C=C1\CCCCC1=O
|
|
MolPort-044-637-531 |
0.64 |
C\C1=C\CC\C(C)=C\CC(CC\C(C)=C/CC1)C(C)(C)O
|
|
MolPort-044-623-113 |
0.64 |
CCC1CCC(=O)C=C1
|
|
MolPort-023-197-958 |
0.64 |
CCC1(C)CCC(=O)C=C1
|
|
MolPort-022-056-577 |
0.64 |
CCC1=CC(=O)CCC1
|
|
MolPort-046-684-157 |
0.64 |
CC(C)[C@@H]1CC(=O)[C@@H](C)CCC=C(C)CC1=O
|
|
MolPort-020-006-015 |
0.64 |
CC(C)[C@@H]1CC(=O)[C@@H](C)CC\C=C(C)\CC1=O
|
|
MolPort-003-846-085 |
0.64 |
[2H]C([2H])([2H])C1=C(C=O)C(C)(C)CCC1([2H])[2H]
|
|
MolPort-003-846-086 |
0.64 |
CC1=C(CO)C(C)(C)CCC1
|
|
MolPort-019-997-258 |
0.64 |
CC(C)C1CC=C(C)C(=O)C1
|
|
MolPort-046-701-995 |
0.64 |
CC(C)[C@@H]1CC(=O)[C@@H](C)CC\C=C(C)/CC1=O
|
|
MolPort-044-615-516 |
0.64 |
CC(C)(C)C1CCC(=O)C=C1
|
|
MolPort-039-338-643 |
0.64 |
COC(C)(C)[C@H](O)[C@@H](O)C[C@@H](C)C1=C2C[C@H](O)[C@H]3[C@@]4(C)CCC(=O)C(C)(C)[C@@H]4CC[C@]3(C)[C@@]2(C)CC1
|
|
MolPort-009-018-337 |
0.64 |
CCCC1(CCC1)C(O)C\C=C\[C@H]1C(O)CC(=O)C1CCCCCCC(=O)OC
|
|
MolPort-046-761-807 |
0.64 |
C[C@H]1C[C@H]2[C@@H]3CC[C@H](C(O)=O)[C@@]3(C)C[C@H](O)[C@@H]2[C@@]2(C)C=CC(=O)C=C12
|
|
MolPort-046-764-888 |
0.64 |
C[C@]12C[C@H](O)[C@H]3[C@@H](CCC4=CC(=O)C=C[C@]34C)[C@@H]1CC[C@@H]2C(O)=O
|
|
MolPort-027-640-864 |
0.64 |
CCCCC(C)(C)[C@H](O)\C=C\[C@H]1[C@H](O)CC(=O)[C@@H]1CC(=O)CCCCC(O)=O
|
|
MolPort-044-183-242 |
0.64 |
CCCC1(CCC1)[C@@H](O)C\C=C\[C@H]1C(O)CC(=O)[C@@H]1CCCCCCC(=O)OC
|
|
MolPort-019-931-806 |
0.64 |
CC1CCC2C(=CC3C(O)C(C)(C)CC123)C(O)=O
|
|
MolPort-009-018-322 |
0.64 |
CCCCCC(O)\C=C\[C@H]1C(O)CC(=O)C1CC(=O)CCCCC(O)=O
|
|
MCULE-6685866242 |
0.64 |
C(C(=O)O)CCCCCCC(O)/C=C/C=C/CCCCC
|
|
MCULE-7399965638 |
0.64 |
CCC/C=C/C=C/C(CC(O)=O)CCC(=O)O
|
|
MCULE-5606035595 |
0.64 |
C1(O)(C)C2CCC(O)(C)C2C/C(=C(\C)/C)/C(=O)C1
|
|
MCULE-1739570677 |
0.64 |
[C@@]12([H])CC[C@@](O)(C)[C@@]1([H])C/C(=C(/C)\C)/C(=O)C[C@]2(O)C
|
|
MCULE-4979255634 |
0.64 |
C1C2C3C=CC3C(C(CO)C2CO)C=1
|
|
MCULE-2026458872 |
0.64 |
C12(C)CC(CC(C)(CO)C1([H])CCC1=CC(C)(C(O)CO)CCC21[H])O
|
|
MCULE-9051465595 |
0.64 |
C1(C2C=CC(C34C=CC23CC=CC4)C1CO)CO
|
|
MCULE-6510021618 |
0.64 |
CC(C(CC1C2C=CC(CC2)C1)=O)N
|
|
MCULE-1177617044 |
0.64 |
C1(=O)CC23CC2(CCC3)C=C1
|
|
MCULE-8004127409 |
0.64 |
C1(C2C3C4C2C2C5C6C7C(C54)(C3=O)C21C6C=C7)=O
|
|
MCULE-5803228201 |
0.64 |
[C@@H]1(O)C(C2[C@@]([H])(CC1)[C@@]1(C)[C@]([H])([C@]3([C@@](C[C@H]1O)(C)[C@@H]([C@H](C)CC[C@@H](O)C(O)(C)C)CC3)C)CC=2)(C)C
|
|
MCULE-4102226627 |
0.64 |
NCC(CC1C2C=CC(CC2)C1)O
|
|
MCULE-2587582031 |
0.64 |
O=C1CCC2(C)C3CC(C4(C)C(CC(C4C3CCC2=C1)=O)C(C)=O)=O
|
|
MCULE-8156503872 |
0.64 |
OC[C@](O)([C@]1(CC[C@@]2(C(CC[C@]3([C@]2(C[C@@](C[C@]3(CO)C)(O)[H])C)[H])=C1)[H])C)[H]
|
|
MCULE-9912389313 |
0.64 |
C1CC2(CO)C(CO)C(C)=CCC2C(CO)(C)C1
|
|
MCULE-6306556319 |
0.64 |
NCC(CC1C2C=CC(CC2)C1)=O
|
|
MCULE-9090579751 |
0.64 |
CC(C(CC1C2C=CC(CC2)C1)=O)(N)C
|
|
MCULE-4277041674 |
0.64 |
C1CC23C(=O)C(=O)C(=O)C2(CCCC3)CC=1
|
|
MCULE-8712180858 |
0.64 |
CC(C(C1(C(O)=O)CC=CC1)C)O
|
|
MCULE-8827470848 |
0.64 |
CC(CC1(C(O)=O)CC=CC1)(O)C
|
|
MCULE-3936888193 |
0.64 |
C12(C)CCC3C(CCC4=CC(=O)CCC34C)C1CC1CC(C)=C(C)CC21C(C)=O
|
|
MCULE-1506005197 |
0.64 |
[C@H]1(O)C[C@@]2(C)[C@]3([H])CC[C@@]([C@@H](O)CO)(C)C=C3CC[C@]2([H])[C@](C)(CO)C1
|
|
MCULE-8516870635 |
0.64 |
[C@]12(O)CC[C@]3(C(CC[C@]3(O)C#N)C1CCC1=CC(=O)CC[C@]21C)C
|
|
MCULE-9323409980 |
0.64 |
[C@]12(C)CCC(C=C1CC[C@]1([H])[C@]2([H])CC[C@]2([C@@]1([H])CC[C@@H]2OC(CCC(C)C)=O)C)=O
|
|
MCULE-8613188927 |
0.64 |
CCCCCCC(O[C@@H]1[C@@]2(C)CC[C@@H]3[C@]4(C)C(=CC(CC4)=O)CC[C@H]3[C@@H]2CC1)=O
|
|
MCULE-9771385800 |
0.64 |
C[C@@H]([C@@H]1[C@]2(C)[C@@]([C@]3([C@@](CC2)([H])[C@]2(C)C(CC(CC2)O)=CC3=O)[H])([H])CC1)CCCC(C(F)(F)F)(F)C(F)(F)F
|
|
MCULE-2384003351 |
0.64 |
C12(C)CCC(C=C1CCC1C2CCC2(C1CCC2OC(CCCCCCCCC)=O)C)=O
|
|
MCULE-9000317976 |
0.64 |
O=C(CCC1CCCC1)O[C@@H]1[C@]2(C)[C@@]([C@]3([C@@](CC2)([H])[C@]2(C)C(=CC(=O)CC2)CC3)[H])([H])CC1
|
|
MCULE-2618463932 |
0.64 |
[C@H]1(O)C[C@]2(C)[C@@]3([H])[C@H](O)C[C@]4(C)[C@@]([H])([C@@](O)([C@H](O)CCC(C)C)C)CC[C@@]4(O)C3=CC(=O)[C@]2([H])C[C@H]1O
|
|
MCULE-1602734224 |
0.64 |
O(C(CCCCCC)=O)[C@H]1CC[C@@H]2[C@]1(C)CC[C@@H]1[C@@]3(C)C(C)=CC(C[C@@H]3CC[C@@H]21)=O
|
|
MCULE-4909263569 |
0.64 |
C[C@]12CCC(=O)C=C1CC[C@@]1([H])[C@]3([H])CC[C@H](OC(=O)CCCCCCCCCC)[C@@]3(C)CC[C@]21[H]
|
|
MCULE-8049371882 |
0.64 |
[C@H]1(O)C[C@]2(C)[C@@]3([H])[C@H](O)C[C@]4(C)[C@@]([H])([C@@](O)([C@H](O)CCC(O)(C)C)C)CC[C@@]4(O)C3=CC(=O)[C@]2([H])C[C@H]1O
|
|
MCULE-4529602980 |
0.64 |
C1(=O)C=C2[C@](C)(CC1)[C@]1([H])[C@]([H])([C@@]3([H])[C@@](CC1)(C)[C@@H](OC(=O)CC)CC3)CC2
|
|
MCULE-8407720746 |
0.64 |
C1(C=C2[C@](C)(CC1)[C@]1([H])[C@]([H])([C@@]3([H])[C@@](CC1)(C)[C@@H](OC(=O)CCCCCCCCCC)CC3)CC2)=O
|
|
MCULE-1044387998 |
0.64 |
C1(=O)CCC2(C)C3CCC4(C)C(OC(=O)CCC5CCCC5)CCC4C3CCC2=C1
|
|
MCULE-8627319345 |
0.64 |
[C@]12(C)CCC(C=C1CC[C@]1([H])[C@]2([H])CC[C@]2([C@@]1([H])CC[C@@H]2OC(CC)=O)C)=O
|
|
MCULE-7045925975 |
0.64 |
C12(C)CCC(C=C1CCC1C2CCC2(C1CCC2OC(CCC(C)C)=O)C)=O
|
|
MCULE-5488659453 |
0.64 |
C12(C)CCC(C=C1CCC1C2CCC2(C1CCC2OC(CC)=O)C)=O
|
|
MCULE-1698252366 |
0.64 |
C12=CC(=O)C3C(C)(CC(C(O)C3)O)C1[C@H](O)CC1(C)C(CC[C@]12O)[C@@](C)(O)[C@@H](O)CCC(C)(C)O
|
|
MCULE-4772039176 |
0.64 |
[C@@]12([H])CCC3=CC(=O)CC[C@]3(C)[C@@]1([H])CC[C@]1(C)[C@H](CC[C@@]21[H])OC(=O)CCC1CCCC1
|
|
MCULE-8245989851 |
0.64 |
C12CC(C=C1)C(C(OC)=O)C2C(O)=O
|
|
MCULE-5874149529 |
0.64 |
[C@@]12([H])CCC3=CC(=O)CC[C@]3(C)[C@@]1([H])CC[C@]1(C)[C@H](CC[C@@]21[H])OC(=O)CCCCCCCCC
|
|
MCULE-3608441851 |
0.64 |
C12(C)CCC3(C([H])(CCC4=CC(=O)CCC43[H])C1([H])CCC2OC(CCCCCCCCC)=O)[H]
|
|
MCULE-5822421820 |
0.64 |
[C@]12(C)CCC(C=C1CC[C@]1([H])[C@]2([H])CC[C@]2([C@@]1([H])CC[C@@H]2OC(CCCCCCCCC)=O)C)=O
|
|
MCULE-8392201259 |
0.64 |
C[C@@]12[C@@H](OC(=O)CCCCCCCCC)CC[C@]1([C@]1([C@]([C@@]3(C(=CC(=O)CC3)CC1)[H])([H])CC2)[H])[H]
|
|
MCULE-7382046053 |
0.64 |
C1(C=C2[C@](C)(CC1)[C@]1([H])[C@]([H])([C@@]3([H])[C@@](CC1)(C)[C@@H](OC(=O)CCCCCC)CC3)CC2)=O
|
|
MCULE-6136215019 |
0.64 |
C1=CC2CC1C(C(=O)OC)C2C(=O)OC
|
|
MCULE-5866611081 |
0.64 |
[C@]12(C)CCC(C=C1CCC1C2CC[C@]2(C1CCC2OC(CCC(C)C)=O)C)=O
|
|
MCULE-7343644414 |
0.64 |
C[C@@]12CC[C@@]3([H])C([C@@H](OC(=O)CCC(=O)O)CC[C@]3(C)C1=CC[C@]1([H])[C@]3([H])C[C@@](C)(C(=O)O)CC[C@]3(C)CC[C@@]21C)(C)C
|
|
MCULE-2316234334 |
0.64 |
C1C=C(C)CCC(C(O)(C)C)C=CC(C)C1
|
|
MCULE-1753855464 |
0.64 |
C1C(C)=CCC(C(=C)CCO)C1
|
|
MCULE-9679008761 |
0.64 |
C12C(CCO)=CCC(C1(C)C)C2
|
|
MCULE-5986847154 |
0.64 |
C1=C(C)CCC2C(C(O)(C)C)CCC2(C)CC(O)C(=C)CC1
|
|
MCULE-2420758748 |
0.64 |
O=C1C2CC(C3CC=CC23)C1
|
|
MCULE-3562867778 |
0.64 |
C1(CC2CC(C=C2)C1)=O
|
|
MCULE-9601196069 |
0.64 |
C12([H])CC=CC1([H])CC(=O)C2
|
|
MCULE-1064684832 |
0.64 |
C1(CCCC)C(=O)CC(C)(C)CC=1C
|
|
MCULE-1721479473 |
0.64 |
C1C(C)=CCC(C(O)(C)C)CCC(C)=CCCC(C)=CC1
|
|
MCULE-2548709406 |
0.64 |
C1=C(C)CC(=O)[C@@H](C(C)C)CC(=O)[C@@H](C)CC1
|
|
MCULE-8149754044 |
0.64 |
C(C1=CC(C)CCC1)=O
|
|
MCULE-8040115902 |
0.64 |
C(C)(C)(C)C1CC(=C2CCC(CC2)C(C)(C)C)C(CC1)=O
|
|
MCULE-5564101474 |
0.64 |
C1C(CC(CC=1C)(C)C)=O
|
|
MCULE-4948873814 |
0.64 |
C1(CCCCC1=O)=CC(CCCC)CC
|
|
MCULE-7819289735 |
0.64 |
C1(CCCC(C)=C1C=O)(C)C
|
|
MCULE-7594121913 |
0.64 |
C1(CCCCC1=O)=CCCCCCC
|
|
MCULE-7553754590 |
0.64 |
C1(=O)[C@@H](C)CCC=C(C)CC(=O)[C@H](C(C)C)C1
|
|
MCULE-2011068282 |
0.64 |
C1(CO)C(C)(C)CCCC=1C
|
|
MCULE-4391727742 |
0.64 |
C1C(CC(CC=1C)C)=O
|
|
MCULE-5887629699 |
0.64 |
C1=C[C@]2(C(=CC1=O)CC[C@@]1([H])[C@]3([H])CC[C@]([H])(C(=O)O)[C@]3(CC([C@]21[H])=O)C)C
|
|
MCULE-6511007969 |
0.64 |
C12C(O)C(C)(C)CC31C(C)CCC3C(C(O)=O)=C2
|
|
MCULE-2528813222 |
0.64 |
C1=C[C@]2(C)C3CC[C@]4(C)C(=O)CCC4C3C[C@@H](CO)C2=CC1=O
|
|
MCULE-9808053205 |
0.64 |
C[C@@H](C1=C2C[C@@H]([C@H]3[C@]4(CCC(C(C)(C)[C@@H]4CC[C@]3(C)[C@@]2(C)CC1)=O)C)O)C[C@@H]([C@H](C(OC)(C)C)O)O
|
|
MCULE-5305214615 |
0.64 |
CC(CCC/C=C/C1CC(O)CC1C(O)/C=C/C(=O)O)=O
|
|
MCULE-2591985853 |
0.64 |
CC1(C(CC2CC=CCC2)=O)OCCC1
|
|
MCULE-1292561691 |
0.64 |
CC1C(C(CC2CC=CCC2)=O)OCC1
|
|
MCULE-2321781017 |
0.64 |
CC1OC(C(CC2CC=CCC2)=O)CC1
|
|
MCULE-2664519273 |
0.64 |
O=C1C(CC2C3C=CC(CC3)C2)COC1
|
|
MCULE-4119972169 |
0.64 |
O=CC1(CCCCC1)CC1CC=CC1
|
|
MCULE-5898882618 |
0.64 |
C/C(/C)=C/CCC1(C(O)(C)CCC1)C
|
|
MCULE-3772551936 |
0.64 |
C/C(/C)=C/CCC1C(=O)CCC1
|
|
MCULE-9964577766 |
0.64 |
CC1CC(CC2CC=CC2)C(=O)CC1
|
|
MCULE-2402052397 |
0.64 |
C/C(/C)=C/CCC1C(O)CCCCC1
|
|
MCULE-2280486224 |
0.64 |
C/C(/C)=C/CCC1C(O)CCC1
|
|
MCULE-7136129743 |
0.64 |
CC1CC(C=O)(CC2CC=CC2)CCC1
|
|
MCULE-9566632126 |
0.64 |
CC1C(C=O)(CC2CC=CC2)CCCC1
|
|
MCULE-1670316367 |
0.64 |
C1(C)(C)C(CC=O)CC=C1C
|
|
MCULE-5812699460 |
0.64 |
OCC1(CCCCC1)CC1CC=CC1
|
|
MCULE-9795786500 |
0.64 |
C/C(/C)=C/CCC1C(=O)CCCCC1
|
|
MCULE-1291038880 |
0.64 |
C[C@H](CCC(=O)OC)[C@@H]1[C@]2(C)[C@@]([C@]3([C@@](CC2)([H])[C@]2(C)[C@](C[C@@H](CC2)O)([H])C(=CC)C3=O)[H])([H])CC1
|
|
MCULE-9029872817 |
0.64 |
C1(CCCCCCCO)C(=O)C[C@@H](O)C=1
|
|
MCULE-8173878510 |
0.64 |
C12(C)C(O)C(=CCC(O)=O)C(CC1)C2(C)C
|
|
MCULE-9975844805 |
0.64 |
O=C(OC1(C2CC3CC(C2)CC1C3)C)C1CC2CC1C=C2
|
|
MCULE-9031983714 |
0.64 |
C1=CC2C3C(C)=C(C)C3C1C(C(OC)=O)C2C(OC)=O
|
|
MCULE-7256161983 |
0.64 |
C1(CC(C)(C)C(C(=C1)C)CC/C(/C)=C/CO)=O
|
|
MCULE-8186617947 |
0.64 |
C1=CC2C3C=C(C)C3C1C(C(OC)=O)C2C(OC)=O
|
|
MCULE-8772466243 |
0.64 |
C1CC23CCOC(=O)C2(CCCC3)CC=1
|
|
MCULE-5737442401 |
0.64 |
OC(C(C#N)CC1CC=CC1)=O
|
|
MCULE-4207554768 |
0.64 |
C12C=CC(C(C(OC)=O)C1C(OC)=O)C1C=CC21
|
|
MCULE-7826570024 |
0.64 |
CC1([C@@H]2CC=C3[C@@]4(C)[C@]([C@@H]([C@H](C(=O)O)CCC(C(C)C)=C)CC4)(C)CC=C3[C@@]2(C)CC[C@@H]1OC(=O)C)C
|
|
MCULE-6540475820 |
0.64 |
CC1(C(C(O)=O)=CCC1)C
|
|
MCULE-8638278493 |
0.64 |
O=C(OC1(CCCCC1)C)C1CC2CC1C=C2
|
|
MolPort-001-757-789 |
0.64 |
CC1=CCC(CC=O)C1(C)C
|
|
MolPort-046-761-951 |
0.64 |
C\C=C1/CC[C@H]2[C@@H]3CC[C@H]4C[C@H](O)CC[C@]4(C)[C@H]3CC[C@]12C
|
|
MolPort-039-338-119 |
0.64 |
C[C@H](CC\C=C(/C)C=O)[C@H]1CC[C@@]2(C)C3=CCC4C(C)(C)[C@@H](O)CC[C@]4(C)C3=CC[C@]12C
|
|
MolPort-039-338-305 |
0.64 |
C[C@H](CC(O)\C=C(/C)C(O)=O)[C@H]1CC[C@@]2(C)[C@@H]3CC[C@@H]4[C@]5(C[C@@]35CC[C@]12C)CCC(=O)C4(C)C
|
|
MolPort-039-052-393 |
0.64 |
C[C@H](CC\C=C(/C)CO)[C@H]1CC[C@@]2(C)C3=CCC4C(C)(C)C(=O)CC[C@]4(C)C3=CC[C@]12C
|
|
MolPort-009-019-193 |
0.64 |
CCCCC\C=C/C\C=C/CC\C=C/CCCC(=O)OC
|
|
MolPort-035-706-316 |
0.64 |
C[C@@H]1CC[C@]2(C)CC[C@]3(C)C4=CC[C@H]5C(C)(C)[C@H](CC[C@]5(C)[C@H]4CC[C@@]3(C)[C@@H]2[C@H]1C)OC(C)=O
|
|
MolPort-000-692-442 |
0.64 |
COC(=O)C1C2C=CC(C3C=CC23)C1C(=O)OC
|
|
MolPort-046-790-365 |
0.64 |
C[C@H](CC(=O)\C=C(\C)[C@H]1CC(=O)[C@@]2(C)C3=C(C(=O)C[C@]12C)[C@@]1(C)CC[C@H](O)C(C)(C)C1C[C@@H]3O)C(O)=O
|
|
MolPort-023-313-258 |
0.64 |
CC1(C)CCC=C1C(O)=O
|
|
MolPort-005-945-241 |
0.64 |
COC(=O)C(C)C1CCC2(C)C(C1O)C(C)(O)C=CC2=O
|
|
MolPort-039-052-540 |
0.64 |
C[C@]1(CCC[C@]2(C)[C@@H]1[C@H](O)C[C@@]13C[C@H](CC[C@@]21O)C(=C)C3=O)C(O)=O
|
|
MolPort-005-944-505 |
0.64 |
C\C(CCC1C(C)=CC(=O)CC1(C)C)=C/CO
|
|
MolPort-039-338-838 |
0.64 |
C[C@H](CC(=O)\C=C(\C)[C@H]1C[C@H](O)[C@@]2(C)C3=C(C(=O)C[C@]12C)[C@@]1(C)CCC(=O)C(C)(C)C1C[C@@H]3O)C(O)=O
|
|
MolPort-039-338-123 |
0.64 |
CC(CC(=O)\C=C(\C)C1CC(=O)[C@@]2(C)C3=C(C(=O)C[C@]12C)[C@@]1(C)CCC(=O)C(C)(C)C1C[C@@H]3O)C(O)=O
|
|
MolPort-039-338-520 |
0.63 |
COC(=O)[C@]12CC[C@@H](C)[C@@](C)(O)[C@H]1C1=CC[C@@H]3[C@@]4(C)CCC(=O)C(C)(C)[C@@H]4CC[C@@]3(C)[C@]1(C)CC2
|
|
MolPort-003-811-448 |
0.63 |
OC1=CC(=O)C2C3CC(C=C3)C12
|
|
MolPort-046-592-361 |
0.63 |
COC(=O)[C@]12CCC(C)(C)C[C@H]1C1=CCC3[C@@]4(C)CC[C@H](OC(C)=O)C(C)(C)C4CC[C@@]3(C)[C@]1(C)CC2
|
|
MolPort-027-640-897 |
0.63 |
CC\C=C/C[C@H](O)\C=C\[C@H]1[C@H](O)C[C@H](O)[C@@H]1CC(=O)CCCCC(O)=O
|
|
MolPort-044-649-784 |
0.63 |
COC(=O)[C@]12CC[C@@H](C)[C@H](C)[C@H]1C1=CC[C@@H]3[C@@]4(C)CC[C@H](OC(C)=O)C(C)(C)[C@@H]4CC[C@@]3(C)[C@]1(C)CC2
|
|
MolPort-023-274-345 |
0.63 |
CCC1=C(C)C(=O)C(C)CC11C(CCC1=O)C(O)=O
|
|
MolPort-027-640-894 |
0.63 |
[Na+].CCCCC[C@H](O)\C=C\[C@H]1[C@H](O)C[C@H](O)[C@@H]1CC(=O)CCC([O-])=O
|
|
MolPort-046-793-260 |
0.63 |
C[C@]12CC[C@H]3[C@@H](C[C@H](Cl)C4=CC(=O)CC[C@]34C)[C@@H]1CC[C@@H]2O
|
|
MolPort-002-511-084 |
0.63 |
CN(C)[C@@H]1CC2C3CC=C4CC(O)CC[C@]4(C)C3CC[C@]2(C)C1C(C)=O
|
|
MolPort-009-019-593 |
0.63 |
CCCCC(F)(F)[C@H](O)CC[C@@H]1[C@@H](C\C=C/CCCC(O)=O)C=CC1=O
|
|
MolPort-044-649-712 |
0.63 |
COC(=O)[C@]12CCC(C)(C)C[C@H]1C1=CC[C@@H]3[C@@]4(C)CC[C@H](OC(C)=O)C(C)(C)[C@@H]4CC[C@@]3(C)[C@]1(C)CC2
|
|
MolPort-035-706-289 |
0.63 |
C[C@@]12[C@H](CC[C@H]1[C@@H]1C=CC3=CC(=O)CC[C@]3(C)[C@H]1CC2=O)[C@H](O)CO
|
|
MolPort-046-673-938 |
0.63 |
COC(=O)[C@@H]1CCC=CCC[C@@H]1N
|
|
MolPort-001-742-502 |
0.63 |
COC(=O)C12CCC(C)C(C)C1C1=CCC3C4(C)CCC(OC(C)=O)C(C)(C)C4CCC3(C)C1(C)CC2
|
|
MolPort-046-701-687 |
0.63 |
CC(=O)C(O)C1(C)CCC2C3CCC4=CC(=O)CCC4=C3CCC12C
|
|
MolPort-039-009-249 |
0.63 |
CC1(C)CC(O)=CC(=O)C11CCC(=O)C=C1
|
|
MolPort-006-148-399 |
0.63 |
CC(C)(O)C1CCC(CO)=CC1
|
|
MolPort-044-723-220 |
0.63 |
CC(C)[C@H]1C[C@H](O)C(C)=C[C@@H]1O
|
|
MolPort-001-742-390 |
0.63 |
C[C@]12CCCC(=C)[C@@H]1C[C@@](O)(CC2)C(=C)C(O)=O
|
|
MolPort-035-705-936 |
0.63 |
CC1(C)[C@H](O)CC[C@@]2(C)[C@@H]3CC[C@@](C)(C=C3CC[C@H]12)[C@@H](O)CO
|
|
MolPort-001-741-466 |
0.63 |
CC1(C)[C@@H](O)CC[C@@]2(C)[C@@H]3CC[C@@](C)(C=C3CC[C@H]12)C(O)CO
|
|
MolPort-001-740-912 |
0.63 |
COC(=O)C1(C)CCCC2(C)C(CCC(C)CC(O)=O)C(=C)CCC12
|
|
MolPort-001-913-566 |
0.63 |
CC(C)(C)C1=CC(CO)CC(CO)C1
|
|
MolPort-005-944-831 |
0.63 |
CC12CCCC(=C)C1CC(CC2O)C(=C)C(O)=O
|
|
MolPort-035-706-220 |
0.63 |
C[C@]12CCCC(=C)[C@@]1(O)C[C@@H](CC2)C(=C)C(O)=O
|
|
MolPort-005-945-145 |
0.63 |
C[C@]12CCCC(=C)[C@@H]1[C@@H](O)[C@@H](CC2)C(=C)C(O)=O
|
|
MolPort-046-761-784 |
0.63 |
C[C@]12CC[C@H]3[C@@H](CCC4=C3CC[C@H](O)C4)[C@@H]1CC[C@@H]2O
|
|
MolPort-042-675-300 |
0.63 |
C[C@@H](CCC=C(C)C)[C@H]1C[C@@H](O)C(C)=C[C@@H]1O
|
|
MolPort-028-610-055 |
0.63 |
CC1(C)CCCC2(C)C(CC(O)C(=C)C(O)=O)C(=C)CCC12
|
|
MolPort-006-115-819 |
0.63 |
C[C@]12CC[C@H]3[C@@H](CCC4=C3CCC(=O)C4)[C@@H]1CCC2=O
|
|
MolPort-003-800-414 |
0.63 |
C[C@@]1(O)CC2C3CC(C=C3)C2[C@@H]1O
|
|
MolPort-035-706-219 |
0.63 |
C[C@]12CCCC(=C)[C@]1(O)C[C@@H](CC2)C(=C)C(O)=O
|
|
MolPort-046-764-572 |
0.63 |
C[C@]12CC[C@@H]3[C@@H](CCC4=C3CC[C@H](O)C4)[C@H]1CC[C@@H]2O
|
|
MolPort-021-804-783 |
0.63 |
CC(C)=C1CC2C(CCC2(C)O)C(C)=CC1=O
|
|
MolPort-038-385-990 |
0.63 |
CC1CCC2C(=CC3(O)CC(C)(C)CC123)C(O)=O
|
|
MolPort-046-689-757 |
0.63 |
[2H]C([2H])([2H])C([2H])([2H])OC(=O)CCCCCCC\C=C/C\C=C/CCCCC
|
|
MolPort-046-689-994 |
0.63 |
C[C@]12C[C@H](O)[C@H]3[C@@H](CCC4=CC(=O)C=C[C@]34C)[C@@H]1CCC2=O
|
|
MolPort-046-684-181 |
0.63 |
CCCCC\C=C\C\C=C/CCCCCCCCCC(=O)OCC
|
|
MolPort-039-337-729 |
0.63 |
CCOC(=O)CCCCC\C=C/C\C=C/C\C=C/C\C=C/C\C=C/CC
|
|
MolPort-044-561-679 |
0.63 |
C[C@@H](CCC=C(C)C)[C@H]1CC[C@]2(C)C[C@H]3[C@H](C(=O)C[C@@]3(C)O)\C(C=O)=C/C[C@@H]12
|
|
MolPort-003-938-896 |
0.63 |
CCCCCCCC\C=C/CCCCCCCC(=O)OC(=O)CCCCCCC\C=C/CCCCCCCC
|
|
MolPort-002-512-390 |
0.63 |
CCCCC[C@H](O)\C=C\[C@H]1CCC(=O)[C@@H]1CCCCCCC(N)=O
|
|
MolPort-003-937-820 |
0.63 |
CCCCC\C=C/C\C=C/CCCCCCCC(=O)OCC
|
|
MolPort-021-782-997 |
0.63 |
CCCCCCCC\C=C\CCCCCCCC(=O)OC(=O)CCCCCCC\C=C\CCCCCCCC
|
|
MolPort-009-019-232 |
0.63 |
CCOC(=O)CCCCCC\C=C/C\C=C/C\C=C/C\C=C/CC
|
|
MolPort-044-183-439 |
0.63 |
C[C@@H](CCC=C(C)C)[C@@]1(O)CC[C@]2(C)C[C@H]3[C@H](C(=O)C[C@@]3(C)O)\C(C=O)=C/C[C@@H]12
|
|
MolPort-003-937-819 |
0.63 |
CCOC(=O)CCCCCCC\C=C/C\C=C/C\C=C/CC
|
|
MolPort-046-690-081 |
0.63 |
C[C@H]1C[C@H]2[C@@H]3CCC(=O)[C@@]3(C)C[C@H](O)[C@@H]2[C@@]2(C)C=CC(=O)C=C12
|
|
MolPort-039-338-595 |
0.63 |
CC(C)=C1C[C@H]2[C@@H](CC[C@]2(C)O)C(C)=CC1=O
|
|
MolPort-002-509-695 |
0.63 |
CC(=O)CC\C=C(\C)CCC1C(C)=CCC2C(C)(C)CCC[C@]12C
|
|
MolPort-035-789-558 |
0.63 |
CC(C)(O)CC1=CCCCC1
|
|
MolPort-046-788-548 |
0.63 |
CC\C=C\CCCCCCCCCCC[C@@H](O)C[C@@H](O)CO
|
|
MolPort-042-622-821 |
0.63 |
O=C1CCC(CC1)=C1CCC1
|
|
MolPort-003-388-175 |
0.63 |
CC(C)=C1CC2C3CCC4CCCCC4(C)C3CCC2(C)C1O
|
|
MolPort-000-719-788 |
0.63 |
CC(C)\C=C1/CCCCC1=O
|
|
MolPort-002-507-663 |
0.63 |
CC(C)\C=C1\CCCCC1=O
|
|
MolPort-001-921-993 |
0.63 |
CC(C)\C=C1/CCCCC1O
|
|
MolPort-006-112-376 |
0.63 |
CC(=O)CC1=CCCCC1
|
|
MolPort-044-388-915 |
0.63 |
CC(=O)CCC=C(C)CCC1C(C)=CCC2C(C)(C)CCCC12C
|
|
MolPort-002-501-996 |
0.63 |
CC(=O)CC1CCC=C1
|
|
MolPort-022-878-942 |
0.63 |
OCCC1=CCCCC1
|
|
MolPort-002-135-314 |
0.63 |
CC(O)CC\C=C(/C)CCC1C(C)=CCC2C(C)(C)CCCC12C
|
|
MolPort-038-934-350 |
0.63 |
[Na+].[Na+].CCCCCCCCCCCCCCCCCC\C(=C/C([O-])=O)C([O-])=O
|
|
MolPort-035-785-432 |
0.63 |
[Na+].CCCCCCCCCCCCCCCCCC\C(=C/C([O-])=O)C(O)=O
|
|
MolPort-039-338-606 |
0.63 |
CC(C)=C1C[C@H]2[C@@H](CC[C@]2(C)O)C(=C)CC1=O
|
|
MCULE-7081887871 |
0.63 |
[C@@H]1(O)CC2[C@](C)(CC1)[C@]1([H])[C@]([H])([C@@]3([H])[C@@](CC1)(C)[C@@H](/C(/C)=C/CO)CC3)CC=2
|
|
MCULE-6129970627 |
0.63 |
C12C3C(C)C(C)C4C56CC(O)C=CC35C6C1C24
|
|
MCULE-7455827757 |
0.63 |
C12(C)C(C(C)=O)CCC1([H])C1(C([H])(C(=O)C2)C2(C)CCC(C=C2CC1)=O)[H]
|
|
MCULE-4656356934 |
0.63 |
FC(C(CC1C2C=CC(CC2)C1)=O)F
|
|
MCULE-4282189276 |
0.63 |
C1(O)CC2(C)C3CC(O)C4(C)C(C(CCC(O)C(O)(C)C)CO)CCC4(C)C=3CCC2C(C)(C)C1O
|
|
MCULE-6238783971 |
0.63 |
[C@@]12(C)[C@@H](C(C)=O)CCC1[C@]1(C(C(=O)C2)[C@@]2(C)CCC(C=C2CC1)=O)[H]
|
|
MCULE-1042513157 |
0.63 |
NC1(C(CC2C3C=CC(CC3)C2)=O)CC1
|
|
MCULE-4315440442 |
0.63 |
C1C[C@]2(C)[C@@]3([H])CC[C@]4(C)[C@@H]([C@@H](/C=C/[C@@H](CC)C(=C)C)C)CC[C@@]4([H])[C@]3([H])CCC2=CC1=O
|
|
MCULE-7604831622 |
0.63 |
C1(C)(CCC(=CBr)C1(C)C)C(O)=O
|
|
MCULE-5994930115 |
0.63 |
NOCC1C2C=CC(CC2)C1
|
|
MCULE-5461214891 |
0.63 |
[C@]12([H])C(=O)C[C@]3(C)[C@H](CC[C@@]3([H])[C@]1([H])CCC1=CC(=O)CC[C@]21C)C(=O)C
|
|
MCULE-7315284280 |
0.63 |
CC(C(CC1C2C=CC(CC2)C1)=O)(F)F
|
|
MCULE-5501982482 |
0.63 |
[H]C12C3(C)CCC(O)CC3(O)CC=C1C1CCC(C(C)C=CC(C)C(C)C)C1(C)CC2
|
|
MCULE-2345630920 |
0.63 |
CC(C(CC1C2C=CC(CC2)C1)=O)(F)C
|
|
MCULE-3779246208 |
0.63 |
OC(C1(CNC1)CC1CC=CCC1)=O
|
|
MCULE-6291067113 |
0.63 |
[C@]12(O)C[C@@H]([C@H](O)[C@]1([H])[C@@H](O)C(=C)CC[C@@]1(C(C)(C)[C@]1([H])C=C(C)C2=O)[H])C
|
|
MCULE-7112192425 |
0.63 |
COC(C(CC1CC=CCC1)N)=O
|
|
MCULE-4026689667 |
0.63 |
C1C(C)(C)C(O)(/C=C/C(O)C)C(C)=CC1=O
|
|
MCULE-1599764188 |
0.63 |
[C@]12(O)C[C@H](C)[C@H](O)[C@]1([H])[C@H](O)C(=C)CC[C@@H]1C(C)(C)[C@@H]1C=C(C)C2=O
|
|
MCULE-3124657861 |
0.63 |
C1[C@]2(CCOC(C)(C)C2)CCC(=O)C=1
|
|
MCULE-6834807417 |
0.63 |
C1C2(CCOC(C)(C)C2)CCC(=O)C=1
|
|
MCULE-2237684707 |
0.63 |
C12(CC(C(=O)C(C)=C1CC)C)C(=O)CCC2C(O)=O
|
|
MCULE-8553860527 |
0.63 |
C12(C3C4C5C(C1OC1C5C3CC1)C1C3CC=CC3C2C14)C=O
|
|
MCULE-6346527900 |
0.63 |
C1(O)C2C3CC(C=C3)C2C(=O)C=1
|
|
MCULE-4084134151 |
0.63 |
O=C1CCC2(CO)C3CCC4(C)C(CCC4C3CCC2=C1)C(N)=O
|
|
MCULE-8247739375 |
0.63 |
C12=CCC3C(C)(CCC4C(C(OC(C)=O)CCC34C)(C)C)C1(C)CCC1(CCC(C)C(C)C21)C(OC)=O
|
|
MCULE-4488369369 |
0.63 |
[C@]12(C)CCC3C(CC=C4CC(O)CC[C@]34C)C1C[C@@H](N(C)C)C2C(C)=O
|
|
MCULE-3192846064 |
0.63 |
C12(C=CC(=O)CC1)C(=O)C=C(O)CC2(C)C
|
|
MCULE-4428281439 |
0.63 |
C1C[C@]2(C)[C@@]3([H])CC(=O)[C@]4(C)[C@@]([H])([C@@H](CO)O)CC[C@@]4([H])[C@]3([H])C=CC2=CC1=O
|
|
MCULE-8159509430 |
0.63 |
C12(CCC(C1(C)C)(C([H])=C([H])C13CCC(C1(C)C)(C(O)=O)C3Br)C2Br)C(O)=O
|
|
MCULE-9641907119 |
0.63 |
C12C(C)(O)C=CC(C1)CC2
|
|
MCULE-5119094209 |
0.63 |
O=C(C12CCCC1C2)C1CCCCC=1
|
|
MCULE-9678628720 |
0.63 |
C1C[C@]2(C)CC[C@@H](C(C(=O)O)=C)C[C@@]2(O)C(=C)C1
|
|
MCULE-5781346358 |
0.63 |
C[C@@]1([C@@H](O)CO)C=C2CC[C@@H]3C(C)(C)[C@H](O)CC[C@@]3(C)[C@@H]2CC1
|
|
MCULE-9469566080 |
0.63 |
C[C@@]12CC[C@@H](O)C(C)(C)[C@@]1([H])CCC1=C[C@@](CC[C@@]21[H])(C)[C@H](CO)O
|
|
MCULE-3339182305 |
0.63 |
C(=C)(C(O)=O)[C@]1(O)CC[C@@]2([C@]([H])(C(CCC2)=C)C1)C
|
|
MCULE-7493111413 |
0.63 |
C12(O)CC=CCC1(C)C1CCC3(C)C(C(C)CCCC(C)C)CCC3C1CC2
|
|
MCULE-2160116138 |
0.63 |
O=C(C1CCCCC=1)[C@@H]1C[C@@H]2C[C@@H]2C1
|
|
MCULE-6718216216 |
0.63 |
CC1CC(CC/C=C(\C)/C)=CC(O)C1
|
|
MCULE-6739386631 |
0.63 |
O=C(C1CCCCC=1)C1CC2C(C2)CC1
|
|
MCULE-6754513691 |
0.63 |
[C@]1([H])([C@@H](C)CC/C=C(\C)/C)[C@@H](O)C=C(C)[C@H](O)C1
|
|
MCULE-4900297288 |
0.63 |
CC1CC(CC2CC=CC2)=CC(=O)C1
|
|
MCULE-9998305986 |
0.63 |
CC(CC1(C(O)=O)CC=CC1)=C
|
|
MCULE-3033801776 |
0.63 |
OC(C12CCCC1C2)C1CCCCC=1
|
|
MCULE-1327216619 |
0.63 |
CC1(CC(CC2CC=CC2)=CC(=O)C1)C
|
|
MCULE-1019761033 |
0.63 |
C1C[C@]2(C)CC[C@@H](C(C(=O)O)=C)C[C@]2(O)C(=C)C1
|
|
MCULE-9232962439 |
0.63 |
C1(CC(CO)CC(CO)C=1)C(C)(C)C
|
|
MCULE-2575543658 |
0.63 |
C1(C2C(C3CC2C=C3)C2C(C3C(C4CC3C=C4)C12)=O)=O
|
|
MCULE-3175746942 |
0.63 |
C12(C)C(=O)C=CC(CC1)C2(C)C
|
|
MCULE-6737121719 |
0.63 |
C1C[C@@]2(CC[C@@H](C(C(=O)O)=C)[C@@H]([C@@]2([H])C(C1)=C)O)C
|
|
MCULE-9379929413 |
0.63 |
C1(O)CC2(C)CC2(C)C=C1
|
|
MCULE-6022003482 |
0.63 |
[C@@H]1(O)C(C)=C[C@H](O)[C@@H](C(C)C)C1
|
|
MCULE-6041020600 |
0.63 |
C12C(=O)C=CC(C1)CC2
|
|
MCULE-6340945460 |
0.63 |
O=C(C12CCCCC1C2)C1CCCCC=1
|
|
MCULE-6555171777 |
0.63 |
C12CC(C3C(=O)CC(=O)C13)C1=C2C2CC1CC2
|
|
MCULE-1731235356 |
0.63 |
O=C(C1CCCCC=1)C1C2C(C2)CCC1
|
|
MCULE-8108304567 |
0.63 |
C/C(/C)=C/CCC1CC(C)(C)CC(=O)C=1
|
|
MCULE-9102303739 |
0.63 |
C12C3CC(C=C3)C1[C@@H]([C@](C)(O)C2)O
|
|
MCULE-9868633193 |
0.63 |
C1CC2(C(O)CC(C(C(=O)O)=C)CC2C(C1)=C)C
|
|
MCULE-4159649248 |
0.63 |
C(C1CC=C(CC=CC(C)C)CC1)=O
|
|
MCULE-8220979425 |
0.63 |
CC1CC(CC/C=C(\C)/C)=CC(=O)C1
|
|
MCULE-1937134104 |
0.63 |
C1CC2(C(CCC(C2CCC(CC(O)=O)C)=C)C(C1)(C(=O)OC)C)C
|
|
MCULE-8676658606 |
0.63 |
C1(O)CC2CC2C=C1
|
|
MCULE-6563356566 |
0.63 |
OC(C1(C2CC2)CC=CC1)=O
|
|
MCULE-4876387221 |
0.63 |
O=C(C1CCCCC=1)CC1CC2C(C2)C1
|
|
MCULE-3659196019 |
0.63 |
C1CC23CC=CCC2(C(O)C(O)C3)CC=1
|
|
MCULE-2200029918 |
0.63 |
OC(C(C1C=CCCCCC1)C#N)=O
|
|
MCULE-7177256815 |
0.63 |
C(CCC(=O)OCC)CCC=CCC=CCC=CCC=CCC=CCC
|
|
MCULE-4110286960 |
0.63 |
[C@@]12([H])CC[C@@](O)(C)[C@@]1([H])C/C(=C(/C)\C)/C(=O)C=C2C
|
|
MCULE-3134302963 |
0.63 |
C(OC(=O)CCCCCCCC=CCCCCCCCC)(=O)CCCCCCCC=CCCCCCCCC
|
|
MCULE-5037820521 |
0.63 |
C1C(CC2(O)C=C(C3C21C(C)CC3)C(=O)O)(C)C
|
|
MCULE-5855122450 |
0.63 |
C12C/C(=C(/C)\C)/C(=O)C=C(C)C1CCC2(C)O
|
|
MCULE-9797468470 |
0.63 |
CCC([C@]1(C)[C@@]2(C)C[C@H](O)[C@@H]3[C@]4(C)C(=CC(C=C4)=O)CC[C@H]3[C@@H]2C[C@H]1C)=O
|
|
MCULE-1984890609 |
0.63 |
C(/CCCCCCCC(OCC)=O)=C/C/C=C\C/C=C\CC
|
|
MCULE-4440606459 |
0.63 |
C1([H])(C(OC)=O)C2C3C4C1C=CC4C([H])(C(OC)=O)C3C=C2
|
|
MCULE-7650700083 |
0.63 |
O=C1C2CC=CCC2(C)C(C(O)=C1)=O
|
|
MCULE-2187659696 |
0.63 |
O=CC1(COCC1)CC1CC=CCC1
|
|
MCULE-4899138148 |
0.63 |
C1C2C3([H])C(C2(C(O)=O)C(O)(C)C)C=CC3C=1
|
|
MCULE-4255982344 |
0.63 |
C(CCCCCCCC=CCC=CCC=CCC)(OCC)=O
|
|
MCULE-5797133433 |
0.63 |
C(OC(=O)CCCCCCCCCC=CCC=CCCCCC)C
|
|
MCULE-6678526334 |
0.63 |
C([C@H]1CCC(=O)[C@@H]1CCCCCCC(N)=O)=C[C@H](CCCCC)O
|
|
MCULE-5773937031 |
0.63 |
C12C3C=CC1C(C(OC)=O)(C)C1C=CC(C3(C(OC)=O)C)C12
|
|
MCULE-4304799829 |
0.63 |
C(CCCCCCCC=CCC=CCCCCC)(OCC)=O
|
|
MCULE-3728655247 |
0.63 |
O=CC1(COCCC1)CC1CC=CCC1
|
|
MCULE-2975110457 |
0.63 |
C(CC(=O)OCC)CCCCC/C=C/C/C=C/C/C=C/CC
|
|
MCULE-7694957039 |
0.63 |
O=C1CCC(OCC2CC=CCC2)CC1
|
|
MCULE-4514313259 |
0.63 |
CCCCCCC(O)CC=CCCCCCCCCO
|
|
MCULE-7334417627 |
0.63 |
CC(CC1CCCCC=1)(O)C
|
|
MCULE-5591347023 |
0.63 |
OC1(C2C(C2)CC1)CC1CC=CC1
|
|
MCULE-4985122843 |
0.63 |
C1C([H])(C)C([H])(CO)C([H])(CO)C([H])(C)C=1
|
|
MCULE-2844730204 |
0.63 |
C12(C)CCC3C(CCC4CCCCC34C)C1C/C(=C(/C)\C)/C2O
|
|
MCULE-2583415836 |
0.63 |
CC(CCC=C(CCC1C2(C)C(C(CCC2)(C)C)CC=C1C)C)=O
|
|
MCULE-4497275799 |
0.63 |
C1(CCCCC1=O)=CC(C)C
|
|
MCULE-9819044866 |
0.63 |
C1([C@H](C)CCC([C@@H](CC=CC(C)(C)C1)C)=O)=O
|
|
MCULE-8536214911 |
0.63 |
C1C(=O)C2([H])CC2([H])C=CCC1
|
|
MCULE-8357419701 |
0.63 |
O=C(C1C2C1CCC2)CC1CC=CC1
|
|
MCULE-3657021044 |
0.63 |
O=C(C1C2C1CCCC2)CC1CC=CC1
|
|
MCULE-8699525142 |
0.63 |
C1(CCCCC1O)=CC(C)C
|
|
MCULE-4233503518 |
0.63 |
OC1(C2C(C2)CCC1)CC1CC=CC1
|
|
MCULE-7795288814 |
0.63 |
C1CC(C(C)=O)(C)C=CC1
|
|
MCULE-8019425107 |
0.63 |
C1C(C(O)C)C=CCC1
|
|
MCULE-5667364535 |
0.63 |
C(C=CC(O)CCCCC)(C)(C)C
|
|
MCULE-6846923078 |
0.63 |
C1(C(C(O)=O)C2CC1C=C2)(C(F)(F)F)C(F)(F)F
|
|
MCULE-9075211166 |
0.63 |
[C@]12(C)CC[C@]3([C@@]([H])(CC=C4C[C@@H](O)CC[C@]34C)[C@]1([H])CC[C@@]12CCC(=O)O1)[H]
|
|
MCULE-1138338360 |
0.63 |
CC12C3(OC(=O)CC3)CCC1C1CC=C3C(C)(C1CC2)CCC(O)C3
|
|
MCULE-1491500449 |
0.63 |
O1C(CC2C1C1(C)C(C2)C2C(CC1)C1(C)CCC(O)CC1=CC2)=O
|
|
MCULE-4330723603 |
0.63 |
[C@H]1(O)C[C@@]2([C@@]3([H])[C@H](O)C[C@@]4([C@@](CC[C@@]4(O)C3=CC([C@]2([H])C[C@H]1O)=O)([H])[C@](O)(C)[C@H](O)C[C@H](O)C(C)C)C)C
|
|
MCULE-1661135480 |
0.63 |
C1C[C@]2(C)[C@@]3(O)CC[C@]4(C)[C@@]([H])([C@@H](/C=C/[C@H](C)C(C)C)C)CC[C@@]4([H])C3=CC(=O)[C@@]2(O)C[C@H]1O
|
|
MCULE-3839963678 |
0.63 |
C(C)(CC(C)CC/C=C(\C)/C)=O
|
|
MCULE-5887388555 |
0.63 |
C(=C/CCC(C)CC(O)C)(/C)\C
|
|
MCULE-1492058519 |
0.63 |
C(O)(=O)C(C)(C)CCC=C
|
|
MCULE-6043142578 |
0.63 |
OC(CCCC=C)=O
|
|
MCULE-2554095482 |
0.63 |
FC(C(CC1C2C=CC(CC2)C1)=O)(F)F
|
|
MCULE-5225411148 |
0.63 |
C12(C)CCCC(C)(C)C1CCC(C)(O)C2C=CC(C)=O
|
|
MolPort-000-208-022 |
0.63 |
CC1(CCC(=O)O1)C1CCC2C3CC=C4C[C@@H](O)CC[C@]4(C)C3CC[C@]12C
|
|
MolPort-046-692-025 |
0.63 |
C[C@]12CC[C@H]3[C@@H](CCC4=CC(=O)CC[C@]34C)[C@@H]1CCC(=O)O2
|
|
MolPort-039-052-523 |
0.63 |
CC(C)[C@@H](C)\C=C\[C@@H](C)[C@H]1CC[C@H]2C3=CC(=O)[C@@]4(O)C[C@@H](O)CC[C@]4(C)[C@@]3(O)CC[C@]12C
|
|
MolPort-046-793-115 |
0.63 |
CC(C)CC[C@@H](O)[C@@H](C)[C@H]1CC[C@@]2(O)C3=CC(=O)[C@@H]4C[C@@H](O)[C@@H](O)C[C@]4(C)[C@H]3C(O)(O)C[C@]12C
|
|
MolPort-035-946-559 |
0.63 |
C[C@]12CC[C@H]3[C@@H](CC=C4C[C@@H](O)CC[C@]34C)[C@@H]1CC[C@]21CCC(=O)O1
|
|
MolPort-001-963-974 |
0.63 |
CC12CCC3C(CC=C4CC(O)CCC34C)C1CCC21CCC(=O)O1
|
|
MolPort-022-365-513 |
0.63 |
CC(CCC=C)C(O)=O
|
|
MolPort-001-793-046 |
0.63 |
OC(=O)CCCC=C
|
|
MolPort-027-631-805 |
0.63 |
CC(C)(CCC=C)C(O)=O
|
|
MolPort-046-418-007 |
0.63 |
C\C(=C/CO)[C@H]1CC[C@H]2[C@@H]3CC=C4C[C@@H](O)CC[C@]4(C)[C@H]3CC[C@]12C
|
|
MolPort-002-509-201 |
0.63 |
CC(=O)[C@H]1CCC2[C@@H]3CCC4=CC(=O)CC[C@]4(C)C3C(=O)C[C@]12C
|
|
MolPort-002-911-134 |
0.63 |
CC12CC(=O)C3C(CCC4=CC(=O)CCC34C)C1CCC2=O
|
|
MolPort-004-960-127 |
0.63 |
CC(=O)[C@H]1CC[C@H]2[C@@H]3CCC4=CC(=O)CC[C@]4(C)[C@H]3C(=O)C[C@]12C
|
|
MolPort-002-070-296 |
0.63 |
C[C@]12CC(=O)[C@H]3[C@@H](CCC4=CC(=O)CC[C@]34C)[C@@H]1CCC2=O
|
|
MolPort-046-683-754 |
0.63 |
C[C@H](CCC=C(C)C)[C@H]1CC=C2C3=C(CC[C@]12C)[C@@]1(C)CC[C@H](O)C(C)(C)[C@@H]1CC3
|
|
MolPort-006-668-567 |
0.63 |
CC(C)(O)C(O)CCC(CO)C1CCC2(C)C3=C(CC(O)C12C)C1(C)CC(O)C(O)C(C)(C)C1CC3
|
|
MolPort-046-761-446 |
0.63 |
[2H]C([2H])([2H])C1([C@@H](O)CC[C@@]2(C)[C@H]1CCC1=C2CC[C@]2(C)[C@H](CC=C12)[C@H](C)CCC=C(C)C)C([2H])([2H])[2H]
|
|
MolPort-023-299-007 |
0.63 |
CC[C@H](\C=C\[C@@H](C)[C@H]1CC[C@H]2[C@@H]3CCC4=CC(=O)CC[C@]4(C)[C@H]3CC[C@]12C)C(C)=C
|
|
MolPort-002-025-718 |
0.63 |
CC(=O)\C=C\C1C(C)(O)CCC2C(C)(C)CCCC12C
|
|
MolPort-046-793-097 |
0.63 |
CC(=O)[C@H]1CC=C2[C@@H]3CCC4=CC(=O)CC[C@]4(C)[C@H]3CC[C@]12C
|
|
MolPort-001-917-870 |
0.63 |
CC1(C)CC2(CCO1)CCC(=O)C=C2
|
|
MolPort-039-338-712 |
0.63 |
C[C@H](C[C@H](O)[C@H]1OC1(C)C)C1=C2CC[C@H]3[C@@]4(C)CCC(=O)C(C)(C)[C@@H]4CC[C@]3(C)[C@@]2(C)CC1
|
|
MolPort-039-052-319 |
0.63 |
C[C@H]1C[C@@]2(O)[C@H]([C@H]1O)[C@H](O)C(=C)CC[C@H]1[C@@H](\C=C(C)/C2=O)C1(C)C
|
|
MolPort-027-640-974 |
0.63 |
CC\C=C/C[C@H](O)\C=C\[C@H]1[C@H](O)C[C@H](O)[C@@H]1C\C=C/CCCC(O)=O
|
|
MolPort-001-740-423 |
0.63 |
CC(O)\C=C\C1(O)C(C)=CC(=O)CC1(C)C
|
|
MolPort-003-804-175 |
0.63 |
C[C@@H](O)\C=C\[C@@]1(O)C(C)=CC(=O)CC1(C)C
|
|
MolPort-039-052-673 |
0.63 |
C[C@@H](O)\C=C\[C@H]1C(CO)=CC(=O)CC1(C)C
|
|
MolPort-039-338-639 |
0.63 |
C[C@H](C[C@H](O)[C@@H](O)C(C)(C)O)C1=C2C[C@H](O)[C@H]3[C@@]4(C)CCC(=O)C(C)(C)[C@@H]4CC[C@]3(C)[C@@]2(C)CC1=O
|
|
MolPort-046-418-653 |
0.63 |
C[C@H]1C[C@@]2(O)[C@H]([C@H]1O)[C@@H](O)C(=C)CC[C@H]1[C@@H](C=C(C)C2=O)C1(C)C
|
|
MolPort-046-702-139 |
0.63 |
C[C@H]1C[C@@]2(O)[C@H]([C@H]1O)[C@@H](O)C(=C)CC[C@H]1[C@@H](\C=C(C)/C2=O)C1(C)C
|
|
MolPort-020-005-740 |
0.63 |
C[C@H]1C[C@@]2(O)[C@H]([C@H]1O)[C@@H](O)C(=C)CC[C@H]1[C@@H](\C=C(C)\C2=O)C1(C)C
|
|
MolPort-035-706-271 |
0.63 |
C[C@H](O)\C=C\[C@@]1(O)C(C)=CC(=O)CC1(C)C
|
|
MolPort-046-594-244 |
0.63 |
CC1CC2(O)C(C1O)C(O)C(=C)CCC1C(C=C(C)C2=O)C1(C)C
|
|
MolPort-046-067-613 |
0.63 |
CC1(C)C[C@@]2(CCO1)CCC(=O)C=C2
|
|
MolPort-001-790-618 |
0.63 |
CC1(C)C2CC1C(C=O)=CC2
|
|
MolPort-001-740-287 |
0.63 |
C\C(CC[C@H]1C(=C)CCC2[C@@](C)(CCC[C@]12C)C=O)=C/CO
|
|
MolPort-035-706-399 |
0.63 |
CC(=O)O[C@H]1CC[C@@]2(C)[C@@H](CC[C@@]3(C)CC4=CC[C@H]5C(C)(C)[C@H](O)CC[C@]5(C)[C@H]4CC[C@H]23)C1(C)C
|
|
MolPort-039-338-791 |
0.63 |
C[C@H](CC(=O)C[C@@H](C)C(O)=O)[C@H]1CC(=O)[C@@]2(C)C3=C(C(=O)[C@@H](O)[C@]12C)[C@@]1(C)CC[C@H](O)C(C)(C)C1CC3=O
|
|
MolPort-039-052-388 |
0.63 |
C[C@H](CCC=C(CO)CO)[C@H]1CC[C@@]2(C)C3=CCC4C(C)(C)C(=O)CC[C@]4(C)C3=CC[C@]12C
|
|
MolPort-035-706-195 |
0.63 |
C[C@@H]1C[C@H](O)[C@@H]2[C@H](C3=C(C)CC[C@H]13)C2(C)C
|
|
MolPort-005-976-303 |
0.63 |
CC1(O)CCC2C3CCC4CC(=O)\C(CC4(C)C3CCC12C)=C\O
|
|
MolPort-001-569-828 |
0.63 |
CC1CCC2C(CC=C3CC(CC[C@]23C)OC(C)=O)C1=O
|
|
MolPort-046-156-337 |
0.63 |
C[C@@]1(O)CC[C@H]2[C@@H]3CCC4CC(=O)\C(C[C@]4(C)[C@H]3CC[C@]12C)=C/O
|
|
MolPort-005-944-433 |
0.63 |
OC(CC(O)=O)C(CCCCCCCCC=C)C(O)=O
|
|
MolPort-035-706-303 |
0.63 |
CC[C@H](\C=C\[C@@H](C)[C@H]1CC[C@H]2C3=CC[C@H]4C[C@H](CC[C@]4(C)[C@H]3CC[C@]12C)OC(C)=O)C(C)C
|
|
MolPort-003-959-059 |
0.63 |
C[C@]1(O)CC[C@H]2[C@@H]3CC[C@H]4CC(=O)\C(C[C@]4(C)[C@H]3CC[C@]12C)=C/O
|
|
MolPort-035-706-367 |
0.63 |
C[C@H](CCC=C(CO)CO)[C@H]1CC[C@@]2(C)C3=CC[C@H]4C(C)(C)C(=O)CC[C@]4(C)C3=CC[C@]12C
|
|
MolPort-001-742-383 |
0.63 |
C\C(CCC(O)C(C)(C)O)=C/CCC(C)(O)C=C
|
|
MolPort-046-153-167 |
0.63 |
CC(CC\C=C(/C)C(O)=O)C1CC(O)C2(C)C3=CCC4C(C)(C)C(=O)CCC4(C)C3=CCC12C
|
|
MolPort-002-509-354 |
0.63 |
CC1=CC2C(CC1CO)C2(C)C
|
|
MolPort-002-509-716 |
0.63 |
O.O=C1[C@@H](C[C@H]2CCCC(C2=O)=C2CCCCC2)CCCC1=C1CCCCC1
|
|
MolPort-006-830-022 |
0.63 |
C[C@]1(O)CCC2C3CC[C@H]4CC(=O)\C(C[C@]4(C)C3CC[C@]12C)=C\O
|
|
MolPort-039-338-839 |
0.63 |
C[C@H](CC\C=C(/C)C(O)=O)[C@H]1C[C@H](O)[C@@]2(C)C3=CCC4C(C)(C)C(=O)CC[C@]4(C)C3=CC[C@]12C
|
|
MolPort-039-338-836 |
0.63 |
C[C@H](CC(=O)\C=C(\C)[C@H]1C[C@H](O)[C@@]2(C)C3=C(C(=O)C[C@]12C)[C@@]1(C)CC[C@H](O)C(C)(C)C1C[C@@H]3O)C(O)=O
|
|
MolPort-046-792-998 |
0.63 |
CC(CCC=C(C)C)C1(O)CCC(C)=CC1
|
|
MolPort-044-755-261 |
0.63 |
C[C@H](CCC=C(C)C)[C@H]1CC[C@@]2(C)C3=C(CC[C@]12C)[C@@]1(C)CC[C@H](OC(C)=O)C(C)(C)[C@@H]1CC3
|
|
MolPort-035-705-927 |
0.63 |
C\C(CC[C@H]1C(=C)CC[C@H]2[C@](C)(CCC[C@]12C)C=O)=C/CO
|
|
MolPort-035-706-320 |
0.63 |
CC(C)=CCC\C(C)=C\CC\C(C)=C\CC\C=C(/C)CC\C=C(/C)CCC(O)C(C)(C)O
|
|
MolPort-046-682-364 |
0.63 |
O=C1CC2CC[C@H]1C=C2
|
|
MolPort-022-367-867 |
0.63 |
CC1(C)CC(=O)C=C(C1)C=O
|
|
MolPort-001-742-706 |
0.63 |
CC(=O)OC1CC2C(CC1(C)C=C)=CCC1C2(C)CCCC1(C)C(O)=O
|
|
MolPort-046-153-052 |
0.63 |
OC(CC(O)=O)C(CCCCCCC=C)C(O)=O
|
|
MolPort-002-512-272 |
0.63 |
O=C1[C@@H](C[C@@H]2CCCC(C2=O)=C2CCCCC2)CCCC1=C1CCCCC1
|
|
MolPort-006-126-764 |
0.63 |
CC1C(C)(C)C2=C(C(=O)CCC2)C1(C)C
|
|
MolPort-001-794-306 |
0.63 |
CC1(C)[C@@H]2C[C@H]1C(C=O)=CC2
|
|
MolPort-035-706-325 |
0.63 |
CC(C)[C@H]1CC[C@H]2[C@@]1(C)CC[C@@]1(C)[C@@H]3CC[C@H]4C(C)(C)[C@H](CC[C@]4(C)C3=CC[C@]21C)OC(C)=O
|
|
MolPort-035-775-548 |
0.63 |
O=C1C[C@@H]2CC[C@H]1C=C2
|
|
MolPort-002-130-829 |
0.63 |
OC1(CCCCC1)\C=C\C1(O)CCCCC1
|
|
MolPort-030-041-203 |
0.62 |
CC1(CCC2C3CCC4=CC(=O)CCC4C3CCC12C)O[Si](C)(C)C
|
|
MolPort-042-675-528 |
0.62 |
CC(C)(O)C1OCC(CC1O)C1CCC2(C)C3=CCC4C(C)(C)C(=O)CCC4(C)C3CCC12C
|
|
MolPort-002-508-454 |
0.62 |
CCCOC(=O)C12CCC(C)(C)CC1C1=CCC3[C@@]4(C)CC(O)C(O)C(C)(C)C4CC[C@@]3(C)[C@@]1(C)CC2
|
|
MolPort-044-559-905 |
0.62 |
C[C@@H]1CC[C@@]2(CC[C@]3(C)C(=CC[C@@H]4[C@@]5(C)CC[C@H](OC(=O)[C@]67CC[C@@H](C)[C@H](C)[C@H]6C6=CCC8[C@@]9(C)CCC(=O)C(C)(C)C9CC[C@@]8(C)[C@]6(C)CC7)C(C)(C)C5CC[C@@]34C)[C@@H]2[C@H]1C)C(O)=O
|
|
MolPort-019-930-789 |
0.62 |
C[C@@]1(CC[C@H]2[C@@H]3CCC4=CC(=O)CC[C@@H]4[C@H]3CC[C@]12C)O[Si](C)(C)C
|
|
MolPort-008-383-041 |
0.62 |
CC1(C)CC(=O)C(C(CO)C2=C(O)CC(C)(C)CC2=O)C(=O)C1
|
|
MolPort-046-687-860 |
0.62 |
Cl.COC(=O)C(N)C1CCC=CC1
|
|
MolPort-046-158-440 |
0.62 |
CC(C)C1=CC(=O)C2=C(CC[C@H]3C(C)=C(CC[C@]23C)C(O)=O)C1=O
|
|
MolPort-035-706-431 |
0.62 |
CC(C)(O)[C@@H]1OC[C@@H](C[C@H]1O)[C@@H]1CC[C@]2(C)C3=CC[C@H]4C(C)(C)C(=O)CC[C@]4(C)[C@H]3CC[C@@]12C
|
|
MolPort-044-183-340 |
0.62 |
OC(=O)CCC\C=C/C\C=C/C\C=C/C\C=C/C\C=C/C#C
|
|
MolPort-009-194-498 |
0.62 |
CCOC(=O)C1CCC(=C)CC1
|
|
MolPort-003-895-993 |
0.62 |
CC\C=C/C\C=C/C\C=C/C\C=C/C\C=C/CCCC(=O)OC
|
|
MolPort-044-561-065 |
0.62 |
OC(=O)CCC\C=C/C\C=C/C\C=C/C\C=C/CCCC#C
|
|
MolPort-035-706-223 |
0.62 |
CC(C)=C1CC[C@]2(C)CCC[C@](C)(O)[C@H]2C1
|
|
MolPort-046-793-307 |
0.62 |
CC(CCO)CC\C=C(/C)CCC=C(C)C
|
|
MolPort-001-766-015 |
0.62 |
CC1CCC(=C(C)C)C(=O)C1
|
|
MolPort-001-791-806 |
0.62 |
O=CC1CCC=CC1
|
|
MolPort-001-791-423 |
0.62 |
CC1CC=CCC1CO
|
|
MolPort-002-506-978 |
0.62 |
CC1CCC2C(C)(C)CCCC2(C)C1CC\C(C)=C/CCC(C)=O
|
|
MolPort-039-337-367 |
0.62 |
C\C=C\C(O)C1CCCCC1
|
|
MolPort-001-791-415 |
0.62 |
OCC1CCC=CC1
|
|
MolPort-006-111-949 |
0.62 |
CC(C)=C1CCC(C)(O)CC1
|
|
MolPort-001-792-446 |
0.62 |
CC1CC=CCC1C=O
|
|
MolPort-001-793-332 |
0.62 |
C[C@@H]1CCC(=C(C)C)C(=O)C1
|
|
MolPort-044-739-536 |
0.62 |
CCCC(CC(O)=O)C=C
|
|
MolPort-044-183-373 |
0.62 |
[2H]C([2H])(\C=C/CCCCCC)C([2H])([2H])C([2H])([2H])C([2H])([2H])C([2H])([2H])C([2H])([2H])C([2H])([2H])C(=O)OC(CCCCCCCCCCCCC)CCCC(O)=O
|
|
MolPort-044-183-375 |
0.62 |
[2H]C([2H])([2H])C([2H])([2H])C([2H])([2H])C([2H])([2H])C([2H])([2H])C([2H])([2H])C([2H])([2H])C([2H])([2H])\C=C/CCCCCCCC(=O)OC(CCCCCCCCCCCCC)CCCC(O)=O
|
|
MolPort-042-675-518 |
0.62 |
CC\C=C/C\C=C/C(O)C(O)C(O)CCCCCCCC(O)=O
|
|
MolPort-037-967-518 |
0.62 |
OC(=O)C(F)C1=CCCCC1
|
|
MolPort-046-793-306 |
0.62 |
CCCCCCCCCC(=O)OCCC(C)CC\C=C(/C)CCC=C(C)C
|
|
MolPort-039-338-547 |
0.62 |
CC(C)=C1C[C@H]2C(CC[C@]2(C)O)=C(C)CC1=O
|
|
MolPort-046-765-240 |
0.62 |
CCCCCCCC\C=C\CCCCCCCC(=O)OCCO
|
|
MolPort-044-561-396 |
0.62 |
CCCCCCCCCCCCCC(CCCC(O)=O)OC(=O)CCCCCCC\C=C/CCCCCC
|
|
MolPort-044-183-364 |
0.62 |
CCCCCCCCCCCCCC(CCCC(O)=O)OC(=O)CCCCCCC\C=C/CCCCCCCC
|
|
MolPort-044-755-231 |
0.62 |
C[C@]12CC[C@H]3[C@@H](CCC4=CC(=O)C=C[C@]34O)[C@@H]1CCC2=O
|
|
MCULE-2358765585 |
0.62 |
O=C1CCCC2C(C(C(C)(C)C1=2)C)(C)C
|
|
MCULE-9145826081 |
0.62 |
C1=CC2CC(O)C3C(C)(O)CC1C23
|
|
MCULE-3981843538 |
0.62 |
C12(C)CCC(CC1=CCC1C(C(C)CCC21)=O)OC(C)=O
|
|
MCULE-7791473919 |
0.62 |
C(C1(CCCCC1)O)=CC1(CCCCC1)O
|
|
MCULE-3107036474 |
0.62 |
C1(O)C2C(O)CC3C2C(C=C3)C1
|
|
MCULE-6569061785 |
0.62 |
C1C2C(C1CC=C2C=O)(C)C
|
|
MCULE-3422795055 |
0.62 |
C1C2CCC(=O)CC=C2C1
|
|
MCULE-1578387226 |
0.62 |
O=C(C1CCCC=1)CC1CC=CC1
|
|
MCULE-9894286158 |
0.62 |
O=C(C1CCCCC=1)C1CC2(CCC2)C1
|
|
MCULE-2581880996 |
0.62 |
C(C)(C)(O)C(O)CC/C(/C)=C/CCC(C)(O)C=C
|
|
MCULE-4612727757 |
0.62 |
C1[C@@H]2C([C@H]1CC=C2C=O)(C)C
|
|
MCULE-4923642243 |
0.62 |
C1(CO)=C(C)CC2CC1C2(C)C
|
|
MCULE-1068654284 |
0.62 |
CC(C(C1CCCCC=1)=O)C1CCC1
|
|
MCULE-7005445792 |
0.62 |
C1CC2(C)C(C(C(=O)O)(C)C1)CC=C1C2CC(OC(C)=O)C(C)(C=C)C1
|
|
MCULE-8993173727 |
0.62 |
C1(C)(C)C(=O)C2([H])CC2([H])CC=C1
|
|
MCULE-7037894510 |
0.62 |
[C@]12(C)CCC(CC1=CCC1C(C(C)CCC21)=O)OC(C)=O
|
|
MCULE-6973355480 |
0.62 |
C1C[C@](C)(C2[C@@](C)([C@@H](CC/C(=C/CO)/C)C(CC2)=C)C1)C=O
|
|
MCULE-7999733772 |
0.62 |
C1CCCCCC2C(C)(C)CC(=O)C2=CCCC1
|
|
MCULE-2546617058 |
0.62 |
C=CCCCCCCCCC(C(=O)O)C(O)CC(=O)O
|
|
MCULE-5658801482 |
0.62 |
C1=CC2CC(=O)C3C(=O)CC1C23
|
|
MCULE-9977163649 |
0.62 |
O=C1CC(C)(C)CC(C=O)=C1
|
|
MCULE-1912400907 |
0.62 |
C12C=C(C)C(CC1C2(C)C)C(C)=O
|
|
MCULE-2793674012 |
0.62 |
CC(C1C2(C)C(O)C(C3C4(C)CCC(O)C(C)(C)C4CC(=O)C=3C2(C)C(=O)C1)=O)CC(CC(C(O)=O)C)=O
|
|
MCULE-1153848413 |
0.62 |
C12(C)C(=O)C(=C)CC1C1C(CC2)C2(C)CCC(CC2=CC1)OC(C)=O
|
|
MCULE-7700432494 |
0.62 |
O=C(C1CCCCC=1)C1C2(CC2)C1
|
|
MCULE-6313856149 |
0.62 |
CC1CC(C(C2CCCCC=2)O)C1
|
|
MCULE-6325460548 |
0.62 |
[C@]12(C)[C@@]([H])(CC[C@]3([H])[C@]1([H])CC[C@]1([C@@]3([H])CC[C@]1(C)O)C)CC(C(=CO)C2)=O
|
|
MCULE-3195811210 |
0.62 |
OC1(C=CCCC1)CC1CC=CC1
|
|
MCULE-2276317128 |
0.62 |
C12C3C(C)(CCC(C)(C(OCC=C)=O)C3)CCC1(C)C1(C(C(=O)C=2)C2(C)CCC(C(C)(C)C2CC1)OC(C)=O)C
|
|
MCULE-5924936253 |
0.62 |
CC1CC(C(C2CCCCC=2)=O)C1
|
|
MCULE-3092137801 |
0.62 |
C(/C=C(\C)/CC/C=C(\C)/CCC(O)C(O)(C)C)C/C=C(\C)/CC/C=C(\C)/CC/C=C(\C)/C
|
|
MCULE-2031126090 |
0.62 |
C1CC2(C)C3=CCC4(C)C(C(CC/C=C(\C)/C(=O)O)C)CC(O)C4(C)C3=CCC2C(C)(C)C1=O
|
|
MCULE-8411365540 |
0.62 |
O=C1[C@@H]2C=C[C@@H](CC2)C1
|
|
MCULE-2750952157 |
0.62 |
O=C(C1CCCCC=1)C1C(C2CC2)C1
|
|
MCULE-1110457062 |
0.62 |
OC(C1CCCCC=1)C1C(C2CC2)C1
|
|
MCULE-6339641467 |
0.62 |
C12(C)C(CCC3C1CCC1(C3CCC1(C)O)C)CC(C(=CO)C2)=O
|
|
MCULE-1903986936 |
0.62 |
CC(C1C(C(C2CCCCC=2)=O)C1)(C)C
|
|
MCULE-1337085089 |
0.62 |
[C@]12(C)[C@@]([H])(CCC3C1CC[C@]1(C3CC[C@]1(C)O)C)CC(C(=CO)C2)=O
|
|
MCULE-9928521209 |
0.62 |
C1C[C@]2(C)[C@@]([H])(CC/C(/C)=C/CO)C(=C)CC[C@@]2([H])[C@@](C)(C=O)C1
|
|
MCULE-6309054443 |
0.62 |
C1=CC2C1C(C(OC)=O)C2C(OC)=O
|
|
MCULE-7331730341 |
0.62 |
C1(C(CO)C2C(=O)CC(CC2=O)(C)C)C(=O)CC(CC=1O)(C)C
|
|
MCULE-4431617841 |
0.62 |
C1CC2(C)C3CCC4(C)C(C5COC(C(O)(C)C)C(O)C5)CCC4(C)C3=CCC2C(C)(C)C1=O
|
|
MCULE-4758818217 |
0.62 |
O=C1C=CC(C2C(C=CCC21)C(O)=O)=O
|
|
MCULE-1329036867 |
0.62 |
C12(C)CCC3(C([H])(CCC4=CC(=O)CCC43[H])C1([H])CCC2(C)O[Si](C)(C)C)[H]
|
|
MCULE-9611860953 |
0.62 |
C(O)(=O)[C@]12[C@@](C3=CC[C@]4([H])[C@]5(C)C(CC[C@]4([C@@]3(CC1)C)C)C(C)(C)[C@@H](OC(=O)[C@]13[C@@](C4=CCC6[C@]7(C)C(CC[C@]6([C@@]4(CC1)C)C)C(C)(C)C(=O)CC7)([H])[C@@H](C)[C@H](C)CC3)CC5)([H])[C@@H](C)[C@H](C)CC2
|
|
MCULE-9256733352 |
0.62 |
[C@]12(C)CC[C@]3([C@@]([H])(CCC4=CC(=O)CC[C@@]43[H])[C@]1([H])CC[C@]2(C)O[Si](C)(C)C)[H]
|
|
MCULE-2014291882 |
0.62 |
C(OCC)(C1CC=C2C1(C)CCC1C2CCC2(O)CC(O)CCC21CO)=O
|
|
MCULE-4442751651 |
0.62 |
C1=CC2C(O)C1C1C(=O)C=CC12
|
|
MCULE-4646294415 |
0.62 |
C(NN)(C1CCC2C1(C)CCC1C2CC=C2CC(O)CCC21C)=O
|
|
MCULE-4483288563 |
0.62 |
[C@]12(C)CC[C@]3([C@@]([H])(CCC4=CC(=O)CC[C@@]43[H])[C@]1([H])CC[C@]2(C)O[Si](C)(C)C)[H]
|
|
MCULE-4801332089 |
0.62 |
C12(CCC(C(=C)C1(C)C)C2)C(OC)=O
|
|
MCULE-2439368404 |
0.62 |
CCC=CCC=CCC=CCC=CCC=CCCCC(=O)OC
|
|
MCULE-2693571114 |
0.62 |
C(OCC)(=O)C1CCC(CC1)=C
|
|
MCULE-7096453126 |
0.62 |
C12(CCC(C(C)(CCC(O)=O)C1=C)C2)C(N)=O
|
|
MCULE-3385582028 |
0.62 |
C1(/CC[C@@](CC/1=O)([H])C)=C(\C)/C
|
|
MCULE-2417213379 |
0.62 |
CC1(C(C(CC2CC=CC2)=O)CCC1)C
|
|
MCULE-8388310463 |
0.62 |
CC1C(C(CC2CC=CC2)=O)CCC1
|
|
MCULE-8065006413 |
0.62 |
CC1C(CC/C=C(\C)/C)(O)CCCC1
|
|
MCULE-9677910881 |
0.62 |
CC1CC(CC/C=C(\C)/C)(O)CCC1
|
|
MCULE-7265382444 |
0.62 |
CCC1C(CC2CC=CC2)(O)CCC1
|
|
MCULE-1413268524 |
0.62 |
CC1C(CC2CC=CC2)(O)CCC1
|
|
MCULE-2532107825 |
0.62 |
C/C(/C)=C/CCC1(CCCCC1)O
|
|
MCULE-4794081286 |
0.62 |
OC1(CCCCCC1)CC1CC=CC1
|
|
MCULE-7311518942 |
0.62 |
CC=CC(CC1C2CCC(CC2)C1)=O
|
|
MCULE-9313043371 |
0.62 |
CCC1CC(CC2CC=CC2)(O)CC1
|
|
MCULE-6288478354 |
0.62 |
C1C[C@@]2(C)CC/C(=C(\C)/C)/C[C@]2([H])[C@@](C)(O)C1
|
|
MCULE-7703110506 |
0.62 |
CC1CC(C(CC2CC=CC2)=O)CC1
|
|
MCULE-1706558387 |
0.62 |
CC1(C(CC2CC=CC2)(O)CCC1)C
|
|
MCULE-3057400120 |
0.62 |
C/C(/C)=C/C(CC1C2CCC(CC2)C1)=O
|
|
MCULE-3304428106 |
0.62 |
CC1CCC(CC/C=C(\C)/C)(O)CC1
|
|
MCULE-1889985819 |
0.62 |
C/C(/C)=C/C(CC1CCCCC1)(O)C
|
|
MCULE-6376135384 |
0.62 |
C1(/CCC(CC/1)(C)O)=C(\C)/C
|
|
MCULE-5407375446 |
0.62 |
CC(C1CCCC1)(CC1CC=CC1)O
|
|
MCULE-9048517900 |
0.62 |
C1C=CCC(CO)(C)C1
|
|
MCULE-7534551137 |
0.62 |
CC1C(CO)CC=CC1
|
|
MCULE-6326954661 |
0.62 |
C1(/CCC(CC/1=O)([H])C)=C(\C)/C
|
|
MCULE-7561786019 |
0.62 |
CC1C(C(CC2CC=CC2)O)CCC1
|
|
MCULE-1433114220 |
0.62 |
O=C(C1CC2(CCC2)C1)CC1CC=CC1
|
|
MCULE-8303528132 |
0.62 |
CC1(C(CC2CC=CC2)=O)CCCC1
|
|
MCULE-7843809650 |
0.62 |
OCC1CC=CCC1
|
|
MCULE-2361055754 |
0.62 |
O=C(C1CCCCCC1)CC1CC=CC1
|
|
MCULE-4752119585 |
0.62 |
C1C(CC=CC1)C=O
|
|
MCULE-1921650357 |
0.62 |
C1(/CC[C@@](CC/1=O)([H])C)=C(\C)/C
|
|
MCULE-7543573924 |
0.62 |
C(C1CC=CCC1C)=O
|
|
MCULE-2258345539 |
0.62 |
O=CC1(C2CC(CC2)C1)CC1CC=CC1
|
|
MCULE-9057383269 |
0.62 |
CC(C(CC1CC=CC1)O)(O)C
|
|
MCULE-7641008425 |
0.62 |
CC1C(CC2CC=CCC2)C(=O)CO1
|
|
MCULE-9612148440 |
0.62 |
O=C1C(CC2CC=CCC2)COC1
|
|
MCULE-2475543698 |
0.62 |
C1(=O)C=CC2(C)C3([H])C(O)CC4(C)C(C(CO)=O)([H])CCC4([H])C3([H])CCC2=C1
|
|
MCULE-1579293561 |
0.62 |
CC/C=C\C/C=C\C(O)C(O)C(O)CCCCCCCC(=O)O
|
|
MCULE-6499225679 |
0.62 |
CC(C(O)=O)(CC1CCCCC=1)N
|
|
MCULE-5625416311 |
0.62 |
OC(C1(CC=CCC1)C/C=C(/Cl)\Cl)=O
|
|
MCULE-8192482534 |
0.62 |
O=C1C=CC2(C)C(C1)CC=CC2
|
|
MCULE-5616063933 |
0.62 |
CC(CCC1(C2C=CC(C2)C1)O)(C)C
|
|
MCULE-3563281112 |
0.62 |
CCC(C1(C2C=CC(C2)C1)O)C
|
|
MCULE-7216680812 |
0.62 |
CC(CC(C1(C2C=CC(C2)C1)O)C)C
|
|
MCULE-2519662703 |
0.62 |
CC(C1(C2C=CC(C2)C1)O)(C)C
|
|
MCULE-2654426987 |
0.62 |
OC1(C2C=CC(C2)C1)CC1CCCC1
|
|
MCULE-2244025879 |
0.62 |
CCC(C1(C2C=CC(C2)C1)O)CC
|
|
MCULE-7237464277 |
0.62 |
CCCCC1(C2C=CC(C2)C1)O
|
|
MCULE-9167476740 |
0.62 |
C/C(/C)=C/CCC1(C2C=CC(C2)C1)O
|
|
MCULE-2200261924 |
0.62 |
CCCC(C1(C2C=CC(C2)C1)O)C
|
|
MCULE-3857929176 |
0.62 |
O=C1C=C(CC2C3C=CC(CC3)C2)CC1
|
|
MCULE-3060260292 |
0.62 |
CC(C1(C2C=CC(C2)C1)O)C
|
|
MCULE-8668421078 |
0.62 |
C/C(/C)=C/CCC1([C@@H]2C=C[C@@H](C2)C1)O
|
|
MCULE-1392126977 |
0.62 |
CCC(CC1(C2C=CC(C2)C1)O)C
|
|
MCULE-8197081732 |
0.62 |
CC(CCC1(C2C=CC(C2)C1)O)C
|
|
MCULE-7241385729 |
0.62 |
C1(=O)C=C(C)CC(C)(C)C1C(C)=O
|
|
MCULE-9740579162 |
0.62 |
C1(C(C)=O)CC(=O)C(C)=CC1
|
|
MCULE-6358122731 |
0.62 |
CC(CC1(C2C=CC(C2)C1)O)C
|
|
MCULE-1638755617 |
0.62 |
O=C(C)C1C(C=C(C)CC1)=O
|
|
MCULE-8078256499 |
0.62 |
OC1(C2CCCC2)C2C=CC(C2)C1
|
|
MCULE-5943346302 |
0.62 |
CCCC1(C2C=CC(C2)C1)O
|
|
MCULE-4775236455 |
0.62 |
CC1(C2(CCC(C=O)=CC2)C(=C)CCC1)C
|
|
MCULE-7471433700 |
0.62 |
CC(C(CC1CC=CCC1)O)(N)C
|
|
MCULE-1143033410 |
0.62 |
OC1(C2C=CC(C2)C1)CC1CC=CC1
|
|
MCULE-1091799520 |
0.62 |
OC1([C@@H]2C=C[C@@H](C2)C1)CC1CC=CC1
|
|
MCULE-9127936983 |
0.62 |
C1C(O)C2(C)CCC(C(C(O)=O)=C)C(O)C2C(=C)C1
|
|
MCULE-3257672801 |
0.62 |
CC(C(CC1CC=CCC1)=O)N
|
|
MCULE-8327721791 |
0.62 |
C12CCC(C(C)(C)C1=CCC(=O)O)C2
|
|
MCULE-4729152230 |
0.62 |
C12CCC(C(C)CCCC(C)C)C1(C)CCC1=C3CCC(O)CC3(C(O)CC21)C
|
|
MCULE-9092899526 |
0.62 |
CC(C(C1(C2C=CC(C2)C1)O)C)C
|
|
MCULE-6305971962 |
0.62 |
C1[C@H](O)[C@]23C[C@@]42CC[C@]2(C)[C@]([C@@H](CCC(=C)C(C)C)C)([H])CC[C@@]2(C)[C@]4([H])CC[C@@]3([H])[C@@](C(=O)O)(C)[C@H]1O
|
|
MCULE-6447505818 |
0.62 |
CCC(C(C1(C2C=CC(C2)C1)O)C)C
|
|
MCULE-3872755173 |
0.62 |
OC1(C2C=CC(C2)C1)CCC=C
|
|
MCULE-1617847451 |
0.62 |
CCC1(C2C=CC(C2)C1)O
|
|
MCULE-8907556285 |
0.62 |
CC(C(CC1CC=CCC1)=O)(N)C
|
|
MCULE-9512042267 |
0.62 |
C12(C)CCC3C(CC=C4CC(O)CCC34C)C1CCC2C(=O)COC(C)=O
|
|
MCULE-5701442831 |
0.62 |
C12(C)CCC(CC1=CCC1C2CCC2(C1CCC2=O)C)OC(C)=O
|
|
MCULE-9728792876 |
0.62 |
C12(C)C(=O)C(C)CC1C1C(CC2)C2(C)CCC(CC2=CC1)OC(C)=O
|
|
MCULE-1470831787 |
0.62 |
C1C[C@]2(C)C3C(=O)C=C4[C@]5([H])CC(C)(C)CC[C@]5(C(=O)O)CC[C@@]4(C)[C@]3(C)CCC2C(C)(C)[C@H]1OC(=O)C
|
|
MCULE-9886067523 |
0.62 |
[C@]12(C)CC[C@]3([C@@]([H])(CC=C4C[C@H](CC[C@]34C)OC(C)=O)[C@]1([H])C[C@@H](CC)[C@@H]2C(C)=O)[H]
|
|
MCULE-9904933861 |
0.62 |
C1(CC(OC)=O)=C(C)C(=O)CC2C(CCCC12C)(C)C
|
|
MCULE-9076166215 |
0.62 |
[C@]12(C)CC[C@]3([C@@]([H])(CC=C4C[C@H](CC[C@]34C)OC(C)=O)[C@]1([H])CC[C@@H]2C(O)=O)[H]
|
|
MCULE-1074800625 |
0.62 |
[C@]12(C)CCC3C(CC=C4CC(CC[C@]34C)OC(C)=O)C1C[C@@H](CC)[C@@H]2C(CC)=O
|
|
MCULE-2274449987 |
0.62 |
C12(C)CCC3C(CC=C4CCCC(OC(C)=O)C34C)C1CC(C)C2(C)C(C)=O
|
|
MCULE-4068140047 |
0.62 |
C(C)(=O)OC1CC2C(C)(C3CCC4(C)C(C(C)C(O)=O)CCC4C3CC=2)CC1
|
|
MCULE-2803933654 |
0.62 |
C12(C)CCC3C(CC=C4CCCC(OC(C)=O)C34C)C1C[C@@H](C)[C@]2(C)C(C)=O
|
|
MCULE-5218628817 |
0.62 |
C12CC(C(C(O)=O)C1C(N)=O)C=C2
|
|
MCULE-7088876584 |
0.62 |
C12(C)CCC3C(CC=C4CC(CCC34C)OC(C)=O)C1CCC2C(C)CCCC(C)=O
|
|
MCULE-7993538244 |
0.62 |
[C@]12(C)CC[C@]3([C@@]([H])(CC=C4C[C@H](CC[C@]34C)OC(C)=O)[C@]1([H])C[C@@H](C)[C@]2(C)C(C)=O)[H]
|
|
MCULE-9945880207 |
0.62 |
[C@@H]12C[C@H]([C@@H](C(O)=O)[C@@H]1C(N)=O)C=C2
|
|
MCULE-7329433097 |
0.62 |
C1(C(O)=O)C(N)C2CC1C=C2
|
|
MCULE-2644546310 |
0.62 |
C1CC2(C(O)(C(O)=O)C(=CC(O)C2C(C1)(C)C)CO)C
|
|
MCULE-9533823250 |
0.62 |
[C@]12(C)CCC3C(CC=C4CC(CC[C@]34C)OC(C)=O)C1CCC2C(C)CCCC(C)=O
|
|
MCULE-8183627372 |
0.62 |
C12(C)CCC3C(CC=C4CC(CCC34C)OC(C)=O)C1CC1CCCCC21C(C)=O
|
|
MCULE-5437278714 |
0.62 |
C12(C)CCC3C(CCC4=CC(=O)CCC34C)C1CCC2(C(OC)=O)C#C
|
|
MCULE-2935787590 |
0.62 |
O=C1C=CC2(C)C(C1)(CCC1C3CCC(C(C)CCC(C)C(C)C)C3(C)CC(C21)OC(C)=O)[H]
|
|
MCULE-6296063373 |
0.62 |
O=C1CCC2(C3CCC4(C)C(CCC4C3CCC2=C1)C(OCC)=O)C=O
|
|
MCULE-9035451811 |
0.62 |
C12(C)CCC3(C([H])(CCC4=CC(=O)CCC34C)C1([H])CCC12CCC(=O)O1)[H]
|
|
MCULE-4910370058 |
0.62 |
C12(C)CCC3C(CC=C4CC(CCC34C)OC(C)=O)C1CCC2C(C)=O
|
|
MCULE-9491535728 |
0.62 |
C12(C)CCC3C(CC=C4CC(CCC34C)OC(C)=O)C1CCC2C(C)CCC(O)=O
|
|
MCULE-1538829806 |
0.62 |
[C@]12(O)CC[C@]3(C(CC=C3C#N)C1CC=C1CC(=O)CC[C@]21C)C
|
|
MCULE-2991933231 |
0.62 |
[C@]12(C)CCC(C=C1CCC[C@@H]2OC(C)(C)C)=O
|
|
MCULE-6095158575 |
0.62 |
C1=C(C(C)C)[C@@]2([H])[C@H]3C(C(C)C)=C[C@H]([C@@](C)(O)C3=O)[C@@]2([H])[C@@](C)(O)C1=O
|
|
MCULE-2122796304 |
0.62 |
C(O)(C12CCC(O)CC1(O)CCC1C3=CCC(C3(C)CCC21)C(OCC)=O)=O
|
|
MCULE-3093682807 |
0.62 |
C12(C)CCC3C(CC=C4CC(CCC34C)OC(C)=O)C1CC(C)C2(C)C(C)=O
|
|
MCULE-9028214804 |
0.62 |
[C@@H]1(OC(C)=O)CC2[C@](C)(CC1)[C@]1([H])[C@]([H])([C@@]3([H])[C@@](CC1)(C)C(=O)CC3)CC=2
|
|
MCULE-3880817234 |
0.62 |
C(C)(=O)OC1CCC2(C)C3CCC4(C)C(C(C)CCC(CC)=O)CCC4C3CC=C2C1
|
|
MCULE-1739744430 |
0.62 |
[C@]12(C)CC[C@]3([C@@]([H])(CCC4=CC(=O)CC[C@]34C)[C@]1([H])CC[C@]12CCC(=O)O1)[H]
|
|
MCULE-7796574971 |
0.62 |
C1(CC(OC)=O)=C(C)C(=O)CC2C(CCC[C@]12C)(C)C
|
|
MCULE-9337389884 |
0.62 |
C(C)(=O)OC1CC2(CC=C3C(=CCC4(C)C(C(C)CCC(OC)=O)CCC43)C2(C)CC1)[H]
|
|
MCULE-4280624613 |
0.62 |
[C@@H]1(C(O)=O)[C@H](N)[C@]2(C[C@]1([H])C=C2)[H]
|
|
MCULE-3810560225 |
0.62 |
C12C(CCC(F)C=1)CC(C(OC)=O)C2
|
|
MCULE-4121090747 |
0.62 |
C12(C)CCC3C(CC=C4CC(CCC34C)OC(C)=O)C1CC(CC)C2C(C)=O
|
|
MCULE-7284740085 |
0.62 |
NC1(C(O)=O)[C@@H]2C=C[C@@H](C2)C1
|
|
MCULE-9723128082 |
0.62 |
C12CC(C=C1)CC2C(OC1(C)CCCC1)=O
|
|
MCULE-4986901322 |
0.62 |
C1C[C@]2(C)C3CC[C@]4(C)[C@]5(O[C@H](C(=O)CC)C[C@H]5C)CC[C@@]4(C)C=3CC[C@@]2([H])[C@@](C)(CO)C1=O
|
|
MCULE-7379708485 |
0.62 |
C12(C)CCC3C(CC=C4CC(CCC34C)OC(C)=O)C1CCC2C(O)=O
|
|
MCULE-6118345848 |
0.62 |
C(C)(=O)OC1CCC2(C)C3CCC4(C)C(C(C)C(CCC(C)C)=O)CCC4C3CC=C2C1
|
|
MCULE-8712822346 |
0.62 |
[C@]12(C)CC[C@]3([C@@]([H])(CC=C4C[C@H](CC[C@]34C)OC(C)=O)[C@]1([H])CC[C@@H]2C(C)=O)[H]
|
|
MCULE-4605464077 |
0.62 |
[C@]12(C)CC[C@@H](CC1=CC[C@]1([H])[C@]2([H])CC[C@]2([C@@]1([H])CCC2=O)C)OC(C)=O
|
|
MCULE-1993565165 |
0.62 |
C1(/CCC(C/1)C(OC)=O)=C(/C)\C
|
|
MCULE-6934635209 |
0.62 |
C1C[C@]2(C)[C@@]3([H])CC[C@]4([C@]5([H])CC(C)(C)CC[C@@]5(CC=C4[C@]3(C)CC[C@@]2([H])C([C@H]1OC(=O)C)(C)C)C)C
|
|
MCULE-4176831119 |
0.62 |
C12(C)CCC(C(OC=O)C1(C)CCC=C2C)C
|
|
MCULE-4790948193 |
0.62 |
OC(=O)CCCCCCCC(/C=C/C=C/C=C/C(=O)CC)=O
|
|
MCULE-3433190262 |
0.62 |
C1(CCCCCCCCCCC=1)C(C)=O
|
|
MCULE-5034253909 |
0.62 |
C(C(C)C)(=O)C1CCCCC=1
|
|
MCULE-9285433930 |
0.62 |
C1(CCCCC=1)C(CC)=O
|
|
MCULE-1585616264 |
0.62 |
C1[C@@H](O)[C@]2(C)CC[C@]([H])(/C=C(/C)\C)[C@@]2([H])[C@](O)(C)C1
|
|
MCULE-9444397237 |
0.62 |
C1CCC(=O)C=CCCC1
|
|
MCULE-9127530652 |
0.62 |
Cl.COC(C(CC1CC=CCC1)N)=O
|
|
MCULE-6849313207 |
0.62 |
CC1CCCC(=O)C=1
|
|
MCULE-7375388626 |
0.62 |
C1(CCCCC=1)C(CCC)=O
|
|
MCULE-8166977907 |
0.62 |
O=C(OCC1CC=CCC1)CC1CCCC1
|
|
MCULE-2488392484 |
0.62 |
[C@]12(C)CC[C@]3([C@@]([H])(CC[C@@]4([H])C[C@H](CC[C@]34C)OC(C)=O)[C@]1([H])CC(C)=C2C(C)=O)[H]
|
|
MCULE-1244483126 |
0.62 |
[C@]12(O)C[C@H](C)[C@H](O)[C@]1([H])[C@H](O)C(=C)[C@H](O)C[C@@H]1C(C)(C)[C@@H]1C=C(C)C2=O
|
|
MCULE-7515900360 |
0.62 |
O=C1CC[C@@H]2[C@]1(C)CC[C@@H]1C3CCC(CC=3C[C@@H](C)[C@@H]21)(OC)OC
|
|
MCULE-7079731514 |
0.62 |
O=C1[C@@]2([C@]([C@H](C(=C)[C@H](O)C[C@]3([H])C(C)(C)[C@]3([H])C=C1C)O)([H])[C@@H](O)[C@@H](C)C2)O
|
|
MCULE-9000594402 |
0.62 |
C[C@@H]1[C@H](O)[C@]2([H])[C@@H](O)C(=C)[C@H](O)C[C@@H]3C(C)(C)[C@@H]3C=C(C)C(=O)[C@@]2(O)C1
|
|
MCULE-3817844296 |
0.62 |
OC/C=C(\C)/CC[C@@H]1[C@]2(C)[C@H](C(C)(C)CCC2)CC[C@@]1(C)O
|
|
MCULE-3035020921 |
0.62 |
C1CCCCC=C(C=O)C1
|
|
MCULE-6881426714 |
0.62 |
O=C1CCCCC1=CCCCC
|
|
MCULE-8489443115 |
0.62 |
C12CC1(C)C(=O)CC(C)(C)C=C2
|
|
MCULE-9420495436 |
0.62 |
O=C1[C@@]2([C@]([C@H](C(=C)[C@H](O)C[C@]3([H])C(C)(C)[C@]3([H])C=C1C)O)([H])[C@@H](O)[C@@H](C)C2)O
|
|
MCULE-2644888783 |
0.62 |
C(=O)(CC(C)C)C1CCCCC=1
|
|
MCULE-5040560976 |
0.62 |
O=C1C(=CC(CC)CC)CCCC1
|
|
MCULE-3363997729 |
0.62 |
C1=CC(=O)C(C([H])=C(C(O)CCCCC)[H])C1CC([H])=C(CCCC(=O)O)[H]
|
|
MCULE-9695902470 |
0.62 |
C1(C)(C)C(C)=CCC1CC(O)CC(=O)C(C)C(=O)OCC
|
|
MCULE-9958324589 |
0.62 |
C1CCCC=C1C(=O)C
|
|
MCULE-4386964450 |
0.62 |
[C@@H]1(C)[C@H](O)[C@]2([H])[C@@H](O)C(=C)[C@H](O)C[C@@H]3C(C)(C)[C@@H]3C=C(C)C(=O)[C@@]2(O)C1
|
|
MCULE-4706828771 |
0.62 |
C12CCC(CC=1C[C@@H](C)[C@]1([H])[C@]2([H])CC[C@]2(C)C(CC[C@@]12[H])=O)(OC)OC
|
|
MCULE-2084098314 |
0.62 |
O=C(/C=C/CCCC[C@H]1C(=O)C[C@@H](O)[C@@H]1/C=C/[C@H](C[C@H](CCCC)C)O)O
|
|
MCULE-1085878457 |
0.62 |
C12CCCCC=1C(C(O)C2C)C
|
|
MCULE-9513148820 |
0.62 |
O=C1C=C(CCC2OCCCC2)CCC1
|
|
MCULE-2672638007 |
0.62 |
C(O)(C)(C)[C@@H]1CC[C@H](C)C2CC[C@H](C)C=2C1
|
|
MCULE-4428185983 |
0.62 |
C1(CCCCC1=O)=CCC(C)C
|
|
MCULE-9669832293 |
0.62 |
[C@@]1(C)([C@H](O)C/C=C(\C)/C)C2CCC(C2)[C@@]1(C)O
|
|
MolPort-002-927-290 |
0.62 |
CC1(C)C2CCC(C2)\C1=C\CC(O)=O
|
|
MolPort-002-911-117 |
0.62 |
CC(C)CCCC(C)C1CCC2C3CC(O)C4(C)CC(O)CCC4=C3CCC12C
|
|
MolPort-023-221-382 |
0.62 |
C[C@@]12CCC[C@H]1[C@@H]1CCC3CC(O)=C(CC=C)C[C@@H]3[C@H]1CC2
|
|
MolPort-044-727-244 |
0.62 |
CC1(C)CCCC(=C)C11CCC(C=O)=CC1
|
|
MolPort-002-510-148 |
0.62 |
CC1(C)CCC2=C1CCC1C2CCC2C[C@@]3(CO3)CC[C@]12C
|
|
MolPort-002-746-923 |
0.62 |
CC(=O)C1CC=C(C)C(=O)C1
|
|
MolPort-035-706-342 |
0.62 |
CC(C)C(=C)CC[C@@H](C)[C@H]1CC[C@@]2(C)[C@@H]3CC[C@@H]4[C@]5(C[C@@]35CC[C@]12C)[C@@H](O)C[C@H](O)[C@@]4(C)C(O)=O
|
|
MolPort-002-506-958 |
0.62 |
CC(=O)C1C(=O)C=C(C)CC1(C)C
|
|
MolPort-000-691-651 |
0.62 |
CC(=O)OC1CCC2(C)C3CCC4(C)C(CCC4=O)C3CC=C2C1
|
|
MolPort-001-989-255 |
0.62 |
NC(=O)C1C2CC(C=C2)C1C(O)=O
|
|
MolPort-046-765-468 |
0.62 |
C[C@H]1C[C@@H]2[C@H](CC[C@@]3(C)[C@H]2CCC(=O)[C@@]3(C)OC(C)=O)[C@@]2(C)CCC(=O)C=C12
|
|
MolPort-000-744-261 |
0.62 |
CC(CCC(O)=O)C1CCC2C3CC=C4CC(CCC4(C)C3CCC12C)OC(C)=O
|
|
MolPort-046-763-326 |
0.62 |
CCOC(=O)CCC[C@@H](C)[C@H]1CC[C@H]2[C@@H]3CC=C4C[C@H](CC[C@]4(C)[C@H]3CC[C@]12C)OC(C)=O
|
|
MolPort-001-825-650 |
0.62 |
COC(=O)CC1=C(C)C(=O)CC2C(C)(C)CCCC12C
|
|
MolPort-002-054-038 |
0.62 |
NC1C2CC(C=C2)C1C(O)=O
|
|
MolPort-000-691-653 |
0.62 |
CC(=O)OCC(=O)C1CCC2C3CC=C4CC(O)CCC4(C)C3CCC12C
|
|
MolPort-035-705-808 |
0.62 |
CC(C)C1=CC(=O)[C@](C)(O)[C@@H]2[C@@H]3C=C(C(C)C)[C@H]([C@H]12)C(=O)[C@]3(C)O
|
|
MolPort-001-535-946 |
0.62 |
CC(=O)OC1CCC2(C)C3CCC4(C)C(CCC4C(C)=O)C3CC=C2C1
|
|
MolPort-046-762-520 |
0.62 |
CC(=O)O[C@]1(CC[C@@H]2[C@@H]3CC=C4C[C@@H](O)CC[C@]4(C)[C@@H]3CC[C@]12C)C(C)=O
|
|
MolPort-000-838-146 |
0.62 |
CC(=O)OC1CC[C@]2(C)C3CC[C@@]4(C)C(CCC4=O)C3CC=C2C1
|
|
MolPort-000-835-607 |
0.62 |
CC(=O)OC1CC[C@]2(C)C3CC[C@@]4(C)C(CCC4C(O)=O)C3CC=C2C1
|
|
MolPort-002-158-100 |
0.62 |
CC(=O)OC1CCC2(C)C3CCC4(C)C(CC5CCCCC45C(C)=O)C3CC=C2C1
|
|
MolPort-000-700-004 |
0.62 |
CC12CCC3C(CCC4=CC(=O)CCC34C)C1CC[C@@]21CCC(=O)O1
|
|
MolPort-046-689-231 |
0.62 |
C[C@]12C[C@H](O)[C@H]3[C@@H](C=CC4=CC(=O)CC[C@]34C)[C@@H]1CC[C@]2(O)C(=O)CO
|
|
MolPort-000-738-028 |
0.62 |
C[C@@H]1CC2C3CC=C4CC(CCC4(C)C3CCC2(C)[C@@]1(C)C(C)=O)OC(C)=O
|
|
MolPort-035-706-372 |
0.62 |
CCC(=O)[C@@H]1C[C@@H](C)[C@]2(CC[C@@]3(C)C4=C(CC[C@]23C)[C@@]2(C)CCC(=O)[C@](C)(CO)[C@@H]2CC4)O1
|
|
MolPort-002-507-126 |
0.62 |
C[C@]12CC[C@H]3[C@@H](CCC4=CC(=O)CC[C@]34C)[C@@H]1CC[C@@]21CCC(=O)O1
|
|
MolPort-002-506-933 |
0.62 |
CC(=O)O[C@H]1CC[C@]2(C)[C@H]3CC[C@@]4(C)[C@@H](CC[C@@H]4C(C)=O)[C@@H]3CC=C2C1
|
|
MolPort-002-506-956 |
0.62 |
CC(=O)O[C@H]1CC[C@]2(C)[C@H]3CC[C@@]4(C)[C@@H](CCC4=O)[C@@H]3CC=C2C1
|
|
MolPort-001-785-924 |
0.62 |
CC(=O)OC1CCC2(C)C3CCC4(C)C(CCC4C(O)=O)C3CC=C2C1
|
|
MolPort-002-525-721 |
0.62 |
CC1(O)OC[C@]23CC=C4[C@@H](CCC5CC(=O)CC[C@]45C)C2CC[C@H]13
|
|
MolPort-002-730-176 |
0.62 |
CC(CCCC(C)=O)C1CCC2C3CC=C4CC(CC[C@]4(C)C3CC[C@]12C)OC(C)=O
|
|
MolPort-002-696-120 |
0.62 |
COC(=O)CC1=C(C)C(=O)CC2C(C)(C)CCC[C@]12C
|
|
MolPort-002-841-867 |
0.62 |
CC(C)CCCC(C)[C@H]1CCC2C3C(CC[C@]12C)[C@@]1(C)CCC(CC1=CC3=O)OC(C)(C)C
|
|
MolPort-002-810-910 |
0.62 |
CCC1CC2C3CC=C4CC(CCC4(C)C3CCC2(C)C1C(C)=O)OC(C)=O
|
|
MolPort-002-510-452 |
0.62 |
C[C@]12CCC3[C@@H](CCC4=CC(=O)CC[C@]34C)C1CC[C@@]21CCC(=O)O1
|
|
MolPort-002-810-909 |
0.62 |
CC1CC2C3CC=C4CC(CCC4(C)C3CCC2(C)C1(C)C(C)=O)OC(C)=O
|
|
MolPort-002-810-764 |
0.62 |
CC(=O)OCC(=O)[C@H]1CCC2C3CC=C4C[C@@H](O)CC[C@]4(C)C3CC[C@]12C
|
|
MolPort-042-646-617 |
0.62 |
C[C@@H]1CC2C3CC=C4CC(CC[C@]4(C)C3CC[C@]2(C)[C@@]1(C)C(C)=O)OC(C)=O
|
|
MolPort-042-646-618 |
0.62 |
CC[C@@H]1CC2C3CC=C4CC(CC[C@]4(C)C3CC[C@]2(C)[C@H]1C(C)=O)OC(C)=O
|
|
MolPort-044-755-262 |
0.62 |
COC(=O)[C@@H](C)[C@H]1CC[C@H]2[C@@H]3CC=C4C[C@H](CC[C@]4(C)[C@H]3CC[C@]12C)OC(C)=O
|
|
MolPort-002-799-650 |
0.62 |
CC(C)(C)O[C@H]1CCCC2=CC(=O)CC[C@]12C
|
|
MolPort-002-510-678 |
0.62 |
CC(=O)O[C@H]1CC[C@]2(C)C3CC[C@@]4(C)C(CC[C@@H]4C(C)=O)[C@@H]3CC=C2C1
|
|
MolPort-046-596-311 |
0.62 |
CC(=O)O[C@@H]1CC[C@]2(C)C3CC[C@@]4(C)C(CC5CCCCC45C(C)=O)C3CC=C2C1
|
|
MolPort-002-798-252 |
0.62 |
CC(=O)O[C@H]1CC[C@]2(C)C3CC[C@@]4(C)C(CCC4=O)C3CC=C2C1
|
|
MolPort-002-686-234 |
0.62 |
C[C@@H]1CC2C3CC=C4CCCC(OC(C)=O)C4(C)C3CCC2(C)[C@@]1(C)C(C)=O
|
|
MolPort-044-811-194 |
0.62 |
C[C@@H]1CC[C@@]2(CC[C@]3(C)C(=CC[C@@H]4[C@]5(C)[C@@H](CC[C@@]34C)[C@](C)(CO)C=C5C#N)[C@@H]2[C@H]1C)C(O)=O
|
|
MolPort-023-221-501 |
0.62 |
CC(=O)OC1CC[C@]2(C)[C@H]3CC[C@@]4(C)[C@@H](CC[C@@H]4C(C)=O)[C@@H]3CC=C2C1
|
|
MolPort-019-937-545 |
0.62 |
CC(=O)O[C@H]1CC[C@@]2(C)C(CC[C@]3(C)C2C(=O)C=C2[C@@H]4CC(C)(C)CC[C@@]4(CC[C@@]32C)C(O)=O)C1(C)C
|
|
MolPort-002-514-858 |
0.62 |
C[C@]12CC[C@@]3(O)C(CC=C4CC(=O)CC[C@]34C)C1CC=C2C#N
|
|
MolPort-002-515-746 |
0.62 |
CC[C@@H]1CC2C3CC=C4CC(CC[C@]4(C)C3CC[C@]2(C)[C@H]1C(=O)CC)OC(C)=O
|
|
MolPort-002-524-141 |
0.62 |
C[C@H](CCC(O)=O)[C@H]1CCC2[C@@H]3CC=C4C[C@@H](CC[C@]4(C)C3CC[C@]12C)OC(C)=O
|
|
MolPort-002-529-651 |
0.62 |
CC(=O)O[C@H]1CC[C@]2(C)[C@H]3CC[C@@]4(C)[C@@H](CC[C@@H]4C(O)=O)[C@@H]3CC=C2C1
|
|
MolPort-002-524-244 |
0.62 |
CC(=O)O[C@@H]1CC[C@]2(C)C3CC[C@@]4(C)C(CC5CCCC[C@@]45C(C)=O)[C@@H]3CC=C2C1
|
|
MolPort-002-528-770 |
0.62 |
CC[C@@H]1C[C@H]2[C@@H]3CC=C4C[C@H](CC[C@]4(C)[C@H]3CC[C@]2(C)[C@H]1C(C)=O)OC(C)=O
|
|
MolPort-002-527-697 |
0.62 |
C[C@@H]1C[C@H]2[C@@H]3CC=C4C[C@H](CC[C@]4(C)[C@H]3CC[C@]2(C)[C@@]1(C)C(C)=O)OC(C)=O
|
|
MolPort-044-649-707 |
0.62 |
CC(=O)O[C@H]1CC[C@@]2(C)[C@@H](CC[C@]3(C)[C@@H]2C(=O)C=C2[C@@H]4CC(C)(C)CC[C@@]4(CC[C@@]32C)C(O)=O)C1(C)C
|
|
MolPort-002-525-874 |
0.62 |
C[C@]12CCC3[C@@H](CCC4=C[C@@H](O)CC[C@]34C)C1CC[C@@]21CCC(=O)O1
|
|
MolPort-002-526-754 |
0.62 |
CC(=O)OCC(=O)[C@H]1CCC2[C@@H]3CC=C4C[C@@H](O)CC[C@]4(C)C3CC[C@]12C
|
|
MolPort-046-596-384 |
0.62 |
CC(CCC(O)=O)C1CCC2C3CC=C4CC(CC[C@]4(C)C3CC[C@]12C)OC(C)=O
|
|
MolPort-044-649-591 |
0.62 |
C[C@@H]1CC[C@@]2(CC[C@]3(C)C(=CC(=O)[C@@H]4[C@@]5(C)CC[C@H](OC(C)=O)C(C)(C)[C@@H]5CC[C@@]34C)[C@@H]2[C@H]1C)C(O)=O
|
|
MolPort-046-597-310 |
0.62 |
CC[C@@H]1CC2C3CC=C4CC(CC[C@]4(C)C3CC[C@]2(C)C1C(C)=O)OC(C)=O
|
|
MolPort-006-170-420 |
0.62 |
N[C@H]1[C@H]2C[C@H](C=C2)[C@H]1C(O)=O
|
|
MolPort-038-387-357 |
0.62 |
N[C@H]1[C@H]2C[C@H](C=C2)[C@H]1C(O)=O.N[C@@H]1[C@@H]2C[C@@H](C=C2)[C@@H]1C(O)=O
|
|
MolPort-002-507-454 |
0.62 |
C[C@@H]1CC2[C@@H]3CC=C4CC(CC[C@]4(C)C3CC[C@]2(C)[C@@]1(C)C(C)=O)OC(C)=O
|
|
MolPort-046-153-129 |
0.62 |
CC1CCC2(C)C(CCC=C2C)C1(C)C\C=C(\CC(O)=O)C=O
|
|
MolPort-035-706-384 |
0.62 |
CC(=O)O[C@H]1CC[C@@]2(C)[C@@H](CC[C@]3(C)[C@@H]2CCC2=C4CC(C)(C)CC[C@]4(C)CC[C@@]32C)C1(C)C
|
|
MolPort-035-706-398 |
0.62 |
CC(=O)O[C@H]1CC[C@@]2(C)[C@@H](CC[C@]3(C)[C@@H]2CC=C2[C@@H]4CC(C)(C)CC[C@]4(C)CC[C@@]32C)C1(C)C
|
|
MolPort-046-158-505 |
0.62 |
CC(=O)O[C@H]1CC[C@@]2(C)[C@@H](CC[C@]3(C)[C@@H]2CC[C@@H]2C4=CC(C)(C)CC[C@]4(C)CC[C@@]32C)C1(C)C
|
|
MolPort-002-508-476 |
0.62 |
CC1CCC2(C)C(C)=CCCC2(C)C1OC=O
|
|
MolPort-005-944-674 |
0.62 |
CCCCCCCCC(=O)\C=C\C=C\C(=O)CCCC(O)=O
|
|
MolPort-035-706-459 |
0.62 |
C[C@@H]1CC[C@]2(C)CC[C@]3(C)C(=CC[C@@H]4[C@@]5(C)CC[C@H](OC(C)=O)C(C)(C)[C@@H]5CC[C@@]34C)[C@@H]2[C@H]1C
|
|
MolPort-020-005-732 |
0.62 |
CC(=O)O[C@H]1CC[C@@]2(C)[C@@H](CC[C@]3(C)[C@@H]2CC[C@@]2(C)[C@@H]4CC(C)(C)CC[C@]4(C)CC=C32)C1(C)C
|
|
MolPort-023-298-927 |
0.62 |
CCC(=O)\C=C\C=C\C=C\C(=O)CCCCCCCC(O)=O
|
|
MolPort-039-338-377 |
0.62 |
CC1=C(C(O)=O)C(C)(C)C[C@H](O)C1
|
|
MolPort-004-964-558 |
0.62 |
CC\C=C/C\C=C/C\C=C/CCCCCCCCO
|
|
MolPort-001-793-302 |
0.62 |
CC1=CC(=O)CCC1
|
|
MolPort-001-793-688 |
0.62 |
CC1=CC(O)CCC1
|
|
MolPort-046-774-142 |
0.62 |
CCC1CC=CC(=O)C1
|
|
MolPort-009-018-407 |
0.62 |
[NH3+]C(CO)(CO)CO.CCCCC[C@H](O)\C=C\[C@H]1[C@H](O)C[C@H](O)[C@@H]1C\C=C/CCCC([O-])=O
|
|
MolPort-035-830-820 |
0.62 |
OC1CCCCCC=C1
|
|
MolPort-002-508-554 |
0.62 |
C\C(CC[C@H]1[C@](C)(O)CC[C@H]2C(C)(C)CCC[C@]12C)=C\CO
|
|
MolPort-046-141-149 |
0.62 |
Cl.COC(=O)C(N)CC1CCC=CC1
|
|
MolPort-023-299-064 |
0.62 |
C\C(CC[C@H]1[C@](C)(O)CC[C@H]2C(C)(C)CCC[C@]12C)=C/CO
|
|
MolPort-027-640-982 |
0.62 |
CCCCC[C@H](O)C\C=C1/[C@@H](C\C=C/CCCC(O)=O)C=CC1=O
|
|
MolPort-001-781-465 |
0.62 |
CC(=O)C1=CCCCC1
|
|
MolPort-003-929-356 |
0.62 |
C[C@H]1CCC2=C1C[C@@H](CC[C@@H]2C)C(C)(C)O
|
|
MolPort-002-506-965 |
0.62 |
CC(=O)O[C@H]1CC[C@@]2(C)[C@@H](CC[C@H]3[C@@H]4CC=C(C(C)=O)[C@@]4(C)CC[C@H]23)C1
|
|
MolPort-038-949-343 |
0.62 |
CC1=C(CO)CCC(C)(C)C1
|
|
MolPort-006-111-517 |
0.62 |
CCCCC\C=C/C\C=C/CCCCCCCCO
|
|
MolPort-020-007-852 |
0.62 |
COC1(CCC2=C(C[C@@H](C)[C@H]3[C@@H]4CCC(=O)[C@@]4(C)CC[C@H]23)C1)OC
|
|
MolPort-037-962-730 |
0.62 |
OCC1CCCCC=C1
|
|
MolPort-035-706-273 |
0.62 |
CC(C)=C[C@H]1CC[C@]2(C)[C@@H]1[C@@](C)(O)CC[C@H]2O
|
|
MolPort-046-790-567 |
0.62 |
CC1=C(C)C(O)CCC1
|
|
MolPort-046-423-244 |
0.62 |
C[C@H]1C[C@@]2(O)[C@H]([C@H]1O)[C@@H](O)C(=C)[C@H](O)C[C@H]1[C@@H](C=C(C)C2=O)C1(C)C
|
|
MolPort-009-018-428 |
0.62 |
[NH3+]C(CO)(CO)CO.CCCCC[C@H](O)\C=C\[C@H]1[C@H](O)C[C@@H](O)[C@@H]1C\C=C/CCCC([O-])=O
|
|
MolPort-016-579-165 |
0.62 |
O=C\C1=C\CCCCCC1
|
|
MolPort-039-338-676 |
0.62 |
C[C@H]1C[C@@]2(O)[C@H]([C@H]1O)[C@H](O)C(=C)[C@H](O)C[C@H]1[C@@H](\C=C(C)/C2=O)C1(C)C
|
|
MolPort-028-196-343 |
0.62 |
O=C(CC1CCCC1)OCC1CCC=CC1
|
|
MolPort-028-747-769 |
0.62 |
CCCCCC=CCC=CCCCCCCCCO
|
|
MolPort-046-025-087 |
0.62 |
CCC1=CCCCC1=O
|
|
MolPort-046-596-271 |
0.62 |
CC(=O)OC1CC[C@@]2(C)[C@@H](CCC3C4CC(C)=C(C(C)=O)[C@@]4(C)CCC23)C1
|
|
MolPort-002-537-209 |
0.62 |
CC(=O)C1=C/CCCCCCCCCC\1
|
|
MolPort-027-641-310 |
0.62 |
CC\C=C/C\C=C/C\C=C/C\C=C/C\C=C/C\C=C/CCCCCCCCCCCCCO
|
|
MolPort-006-394-788 |
0.62 |
[2H]C([2H])([2H])[C@@H](CCCC)C[C@H](O)\C=C\[C@H]1[C@H](O)CC(=O)[C@@H]1CCCC\C=C\C(O)=O
|
|
MolPort-009-018-417 |
0.62 |
[NH3+]C(CO)(CO)CO.CCCCC[C@H](O)\C=C\[C@H]1[C@H](O)C[C@H](O)[C@@H]1C\C=C\CCCC([O-])=O
|
|
MolPort-046-594-201 |
0.62 |
CC1CC2(O)C(C1O)C(O)C(=C)C(O)CC1C(C=C(C)C2=O)C1(C)C
|
|
MolPort-001-740-290 |
0.62 |
C\C(CC[C@@H]1[C@@](C)(O)CCC2C(C)(CO)CCC[C@@]12C)=C\CO
|
|
MolPort-002-520-650 |
0.62 |
CC(=O)OC1CC[C@@]2(C)[C@@H](CC[C@H]3[C@@H]4CC=C(C(C)=O)[C@@]4(C)CC[C@H]23)C1
|
|
MolPort-001-840-675 |
0.62 |
CC(=O)OC1CCC2(C)[C@@H](CCC3C4CC=C(C(C)=O)C4(C)CCC23)C1
|
|
MolPort-003-939-186 |
0.62 |
NC(CO)(CO)CO.CCCCC[C@H](O)\C=C\[C@H]1[C@H](O)C[C@H](O)[C@@H]1C\C=C/CCCC(O)=O
|
|
MolPort-008-348-849 |
0.62 |
CC(C)C\C=C1/CCCCC1=O
|
|
MolPort-002-530-021 |
0.62 |
CC(=O)O[C@H]1CC[C@@]2(C)[C@@H](CC[C@H]3[C@@H]4CC(C)=C(C(C)=O)[C@@]4(C)CC[C@H]23)C1
|
|
MolPort-046-701-785 |
0.62 |
NC(CO)(CO)CO.CCCCCC(O)\C=C\C1C(O)CC(O)C1C\C=C\CCCC(O)=O
|
|
MolPort-003-959-398 |
0.62 |
CCCCC[C@H](O)\C=C\[C@@H]1[C@@H](C\C=C/CCCC(O)=O)C=CC1=O
|
|
MolPort-023-220-421 |
0.62 |
NC(CO)(CO)CO.CCCCC[C@](C)(O)\C=C\[C@H]1[C@H](O)C[C@H](O)[C@@H]1C\C=C/CCCC(O)=O
|
|
MolPort-046-418-679 |
0.62 |
C[C@H]1C[C@@]2(O)[C@H]([C@H]1O)[C@@H](O)C(=C)[C@H](O)C[C@H]1[C@@H](\C=C(C)/C2=O)C1(C)C
|
|
MolPort-006-823-932 |
0.62 |
CCCC[C@H](C)C[C@H](O)\C=C\[C@H]1[C@H](O)CC(=O)[C@@H]1CCCC\C=C\C(O)=O
|
|
MolPort-046-790-393 |
0.62 |
CC(C)=C1C[C@H]2C(=C)CCC[C@]2(C)CC1=O
|
|
MolPort-046-702-685 |
0.62 |
CCCCCC(O)\C=C\[C@@H]1C(C\C=C\CCCC(O)=O)C=CC1=O
|
|
MolPort-028-603-498 |
0.62 |
CC(C)C\C=C1\CCCCC1=O
|
|
MolPort-046-790-351 |
0.62 |
C[C@@H]1CCC=C2C(=O)C=C[C@@H](C(C)(C)O)[C@@]12C
|
|
MolPort-001-740-292 |
0.62 |
C\C(CC[C@@H]1[C@@](C)(O)CCC2C(C)(C)CCC[C@@]12C)=C\CO
|
|
MolPort-027-835-567 |
0.61 |
O=C1OC(=O)[C@@H]2[C@H]1[C@@H]1CC[C@@H]2C=C1
|
|
MolPort-000-734-484 |
0.61 |
CC(C)C1=CC23CCC4C(C)(CCCC4(C)C(O)=O)C2CC1C1C3C(=O)OC1=O
|
|
MolPort-002-139-577 |
0.61 |
CC(=O)OC1CCC2(C)C3CCC4(C)C(CC5CC=CCC45C(C)=O)C3CC=C2C1
|
|
MolPort-035-769-790 |
0.61 |
O=C1OC(=O)C2C1[C@H]1CC[C@@H]2C=C1
|
|
MolPort-002-509-633 |
0.61 |
CC(=O)O[C@@H]1CC[C@]2(C)C3CC[C@@]4(C)C(CC5CC=CCC45C(C)=O)C3CC=C2C1
|
|
MolPort-002-516-481 |
0.61 |
CC(C)C1=CC23CCC4[C@](C)(CCC[C@@]4(C)C(O)=O)C2CC1[C@@H]1[C@H]3C(=O)OC1=O
|
|
MolPort-001-764-908 |
0.61 |
O=C1OC(=O)C2C1C1CCC2C=C1
|
|
MolPort-044-811-193 |
0.61 |
COC(=O)[C@]12CC[C@@H](C)[C@H](C)[C@H]1C1=CC(=O)[C@@H]3[C@]4(C)[C@@H](CC[C@@]3(C)[C@]1(C)CC2)[C@](C)(CO)C=C4C=O
|
|
MolPort-001-767-705 |
0.61 |
C[C@]12CCC(=O)C=C1CCCC2=O
|
|
MolPort-022-365-293 |
0.61 |
CC1CCC(=C1)C(O)=O
|
|
MolPort-001-781-972 |
0.61 |
CC12CCC(=O)C=C1CCCC2=O
|
|
MolPort-046-153-107 |
0.61 |
CC(C)C(\C=C\C(C)C1CCC2C3C(O)C=C4CC(O)CCC4(C)C3CCC12C)C(C)O
|
|
MolPort-046-764-593 |
0.61 |
CC(C)CCC[C@@H](C)[C@H]1CC[C@H]2C3[C@H](O)C=C4C[C@@H](O)CC[C@]4(C)[C@H]3CC[C@]12C
|
|
MolPort-046-764-595 |
0.61 |
[2H]C([2H])([2H])C([2H])(CCC[C@@H](C)C1CC[C@H]2C3[C@@H](O)C=C4C[C@@H](O)CC[C@]4(C)[C@H]3CC[C@]12C)C([2H])([2H])[2H]
|
|
MolPort-016-584-574 |
0.61 |
CCCC12CCC(=O)C=C1CCCC2=O
|
|
MolPort-039-052-443 |
0.61 |
CC[C@H](CC[C@@H](C)[C@H]1CCC2C3=C(CC[C@]12C)[C@@]1(C)CC[C@H](O)CC1=CC3)C(C)C
|
|
MolPort-046-703-143 |
0.61 |
CC(C)CCC[C@@H](C)[C@H]1CC[C@H]2[C@@H]3C(O)C=C4C[C@@H](O)CC[C@]4(C)[C@H]3CC[C@]12C
|
|
MolPort-027-720-869 |
0.61 |
CC1(C)[C@H]2C[C@@H](O)[C@@]34[C@H](O)[C@@H](CC[C@H]3[C@]2(C)CCC1=O)C(=C)C4=O
|
|
MolPort-042-665-810 |
0.61 |
CC(=O)[C@H]1CC[C@H]2[C@@H]3CCC4=CC(=O)CC[C@]4(C=C)[C@H]3CC[C@]12C
|
|
MolPort-000-003-562 |
0.61 |
CCC1=C(O)C(=O)CC1
|
|
MolPort-044-561-082 |
0.61 |
C[C@H](CCCC(C)(C)O)[C@H]1CC[C@H]2[C@@H]3[C@H](O)C=C4C[C@@H](O)CC[C@]4(C)[C@H]3CC[C@]12C
|
|
MolPort-046-426-780 |
0.61 |
[2H]C([2H])([2H])C([2H])(CCC[C@@H](C)[C@H]1CC[C@H]2[C@@H]3[C@H](O)C=C4C[C@@H](O)CC[C@]4(C)[C@H]3CC[C@]12C)C([2H])([2H])[2H]
|
|
MolPort-035-706-295 |
0.61 |
CC[C@H](\C=C\[C@@H](C)[C@H]1CC[C@H]2[C@@H]3[C@H](O)C=C4C[C@@H](O)CC[C@]4(C)[C@H]3CC[C@]12C)C(C)C
|
|
MolPort-035-706-291 |
0.61 |
CC[C@H](CC[C@@H](C)[C@H]1CC[C@H]2[C@@H]3[C@H](O)C=C4C[C@@H](O)CC[C@]4(C)[C@H]3CC[C@]12C)C(C)C
|
|
MolPort-046-426-781 |
0.61 |
[2H]C([2H])([2H])C([2H])(CCC[C@@H](C)[C@H]1CC[C@H]2[C@@H]3[C@@H](O)C=C4C[C@@H](O)CC[C@]4(C)[C@H]3CC[C@]12C)C([2H])([2H])[2H]
|
|
MolPort-046-690-006 |
0.61 |
CC(C)CCC[C@@H](C)[C@H]1CC[C@H]2[C@@H]3CC=C4[C@H](O)[C@@H](O)CC[C@]4(C)[C@H]3CC[C@]12C
|
|
MolPort-006-169-894 |
0.61 |
CC(C)CCC[C@@H](C)[C@H]1CC[C@H]2[C@@H]3[C@@H](O)C=C4C[C@@H](O)CC[C@]4(C)[C@H]3CC[C@]12C
|
|
MolPort-006-394-340 |
0.61 |
[2H]C([2H])([2H])C([2H])(CCC[C@@H](C)[C@H]1CC[C@H]2[C@@H]3CC=C4[C@@H](O)[C@@H](O)CC[C@]4(C)[C@H]3CC[C@]12C)C([2H])([2H])[2H]
|
|
MolPort-002-054-253 |
0.61 |
CC1=C2CCCC(=O)[C@@]2(C)CCC1=O
|
|
MolPort-039-339-158 |
0.61 |
CC(C)CCC[C@@H](C)[C@H]1CC[C@H]2[C@@H]3CC=C4[C@@H](O)[C@@H](O)CC[C@]4(C)[C@H]3CC[C@]12C
|
|
MolPort-046-689-739 |
0.61 |
[2H]C([2H])([2H])C([2H])([2H])OC(=O)CCC\C=C/C\C=C/C\C=C/C\C=C/CCCCC
|
|
MolPort-006-118-882 |
0.61 |
CC(C)CCCC(C)CCCC(C)CCCC(C)(O)CCC1=C(C)C(=O)C(C)=C(C)C1=O
|
|
MolPort-003-940-344 |
0.61 |
CCCCC\C=C/C\C=C/C\C=C/C\C=C/CCCC(=O)OCC
|
|
MolPort-023-220-687 |
0.61 |
CC(C)CCC[C@@H](C)CCC[C@@H](C)CCC[C@@](C)(O)CCC1=C(C)C(=O)C(C)=C(C)C1=O
|
|
MolPort-046-687-677 |
0.61 |
COC(=O)C1(CCC=CC1)C=O
|
|
MolPort-039-139-179 |
0.61 |
CCOC(=O)CCCC\C=C/C\C=C/C\C=C/C\C=C/CC
|
|
MolPort-039-339-228 |
0.61 |
C[C@@H](CC[C@@H](O)C(C)=C)[C@@H]1CC[C@]2(C)C3=CC[C@H]4C(C)(C)[C@H](CC[C@]4(C)[C@H]3CC[C@@]12C)OC(C)=O
|
|
MolPort-044-755-196 |
0.61 |
CC(C)(C)C(=O)O[C@H]1CC[C@H]2[C@@H]3CCC4=CCCC[C@]4(C)[C@H]3CC[C@]12C
|
|
MolPort-029-879-134 |
0.61 |
COC(=O)C1CCCC=C1
|
|
MolPort-035-706-345 |
0.61 |
COC(=O)CC[C@]12C[C@]11CC[C@]3(C)[C@H](CC[C@@]3(C)[C@@H]1CC[C@H]2C(=C)CO)[C@H](C)CC\C=C(/C)C=O
|
|
MolPort-046-508-487 |
0.61 |
COCC1(CCC=CC1)C(O)=O
|
|
MolPort-035-706-430 |
0.61 |
C[C@@H]([C@H]1OC(C)(C)[C@@H](O)[C@H]1O)[C@@H]1CC[C@]2(C)C3=CC[C@H]4C(C)(C)C(=O)CC[C@]4(C)[C@H]3CC[C@@]12C
|
|
MolPort-000-451-609 |
0.61 |
CC12C=C(Br)C1CCC2(C)C([O-])=O
|
|
MolPort-044-755-257 |
0.61 |
CC(=O)O[C@H]1CCC2[C@H]3CCC4=C(CC[C@]4(C)[C@@H]3C[C@@H](O)[C@]2(C)C1)C(C)=O
|
|
MolPort-042-609-423 |
0.61 |
OC1=CC2=CC(=O)CCC2CC1
|
|
MCULE-4596748719 |
0.61 |
C12(CCC)CCC(C=C1CCCC2=O)=O
|
|
MCULE-4552456295 |
0.61 |
O=C1CCC2(C)C3CCC4(C)C(=CC=C)CCC4C3CCC2=C1
|
|
MCULE-2386800783 |
0.61 |
O(C1CC2CC1C1C2C2CC1C=C2)C(C)=O
|
|
MCULE-3588728893 |
0.61 |
C1(C)C(=O)C(C)=C(CC[C@](C)(O)CCC[C@H](C)CCC[C@H](C)CCCC(C)C)C(=O)C=1C
|
|
MCULE-7507181537 |
0.61 |
[C@]12(CCC(=O)OC)C[C@@]31CC[C@]1(C)[C@@]([H])([C@@H](CC/C=C(\C)/C=O)C)CC[C@@]1(C)[C@]3([H])CC[C@@]2([H])C(=C)CO
|
|
MCULE-3543018898 |
0.61 |
CC1([C@@H]2CC=C3[C@]4(C)[C@@]([C@H]([C@H](CC[C@H](C(=C)C)O)C)CC4)(C)CC[C@@H]3[C@@]2(C)CC[C@@H]1OC(=O)C)C
|
|
MCULE-9439225491 |
0.61 |
CC1C(=O)C(C)=C(CC[C@](O)(CCC[C@@H](CCC[C@@H](CCCC(C)C)C)C)C)C(=O)C=1C
|
|
MCULE-1529769635 |
0.61 |
CC(C(C)=O)CC1CC=CC1
|
|
MCULE-8631883359 |
0.61 |
CC(C(CC1CC=CC1)=O)(C)C
|
|
MCULE-7597802130 |
0.61 |
O=C1C(=NO)CC2C1(C)CCC1C2CC=C2CC(O)CCC21C
|
|
MCULE-1997774461 |
0.61 |
C12(C)C(CCC1(C)C(O)=O)C(=C2)Br
|
|
MCULE-3821406584 |
0.61 |
C12C(CCC(=O)C=1)CCC(O)=C2
|
|
MCULE-2589305143 |
0.61 |
CC1C(=O)CCC1CC/C=C(\C)/C
|
|
MCULE-1810658219 |
0.61 |
C/C(/C)=C/CCC1(CC(=O)CC1)C
|
|
MCULE-2246342919 |
0.61 |
C/C(/C)=C/CCC1CC(O)CCCC1
|
|
MCULE-5058412241 |
0.61 |
CC(C(CC1CC=CC1)(O)C)(C)C
|
|
MCULE-1607606730 |
0.61 |
CC1C(CC/C=C(\C)/C)CCC1O
|
|
MCULE-3444922346 |
0.61 |
C/C(/C)=C/CCC1(CC(O)CC1)C
|
|
MCULE-3732793313 |
0.61 |
C/C(/C)=C/CCC1CC(O)CC1
|
|
MCULE-4520792651 |
0.61 |
CC(C(CC1CC=CC1)O)(C)C
|
|
MCULE-4311460031 |
0.61 |
CC(C(CC1CC=CC1)O)C
|
|
MCULE-1390580548 |
0.61 |
C1C[C@@]2(C)C(CC[C@@H]2O)=C(C1=O)C(O)=O
|
|
MCULE-1323244269 |
0.61 |
O=C(C1CCCC=1)C1CC2(CC2)CCC1
|
|
MCULE-5824284147 |
0.61 |
O=C(C1C2C(C2)CCC1)CC1CCCC=1
|
|
MCULE-5551120975 |
0.61 |
C(CCCCCCCCC=C)(OC)=O
|
|
MCULE-1843303649 |
0.61 |
C(CCCCCCCC=C)(OC)=O
|
|
MCULE-5531656338 |
0.61 |
CC1C(=O)C(C)(C)CC(=O)C=1
|
|
MCULE-6547047070 |
0.61 |
O=C(C12CCCCC1C2)CC1CCCC=1
|
|
MCULE-8779705243 |
0.61 |
OC(C12CCCC1C2)CC1CCCC=1
|
|
MCULE-9326244207 |
0.61 |
O=C(C1CCCC=1)C1CCC2(CC2)CC1
|
|
MCULE-4374730563 |
0.61 |
O=C1CC2CCCCC2=C1
|
|
MCULE-3650003593 |
0.61 |
O=C1C=C(CC2CC=CCC2)CCCC1
|
|
MCULE-8180565288 |
0.61 |
O=C1C=C(CC2C3CCC(CC3)C2)CC1
|
|
MCULE-1877898399 |
0.61 |
O=C(C1CC2C(C2)CC1)CC1CCCC=1
|
|
MCULE-9382333306 |
0.61 |
C1(C)(C)CC(=O)C2=C(C)CCC12
|
|
MCULE-6595352093 |
0.61 |
O=C(C12CCCC1C2)CC1CCCC=1
|
|
MCULE-1747951282 |
0.61 |
C1CC23C=CC(O)([H])C2(CCCC3)CC1
|
|
MCULE-3440045209 |
0.61 |
O=C([C@H]1C[C@@H]2[C@@H](C2)C1)CC1CCCC=1
|
|
MCULE-8255659287 |
0.61 |
C1(=O)CCC(CC=C)(C)C=C1
|
|
MCULE-9928356247 |
0.61 |
C12C3C4C5C(C(C(=O)C1=O)C4CC3)C=CC25
|
|
MCULE-1022777486 |
0.61 |
C(OC)(=O)C(CCCC=C)CCCC=C
|
|
MCULE-5582529261 |
0.61 |
C/C(=C/CC/C(/C(O)=O)=C\CC/C(/C)=C/CC/C(/CO)=C/CO)/C
|
|
MCULE-3626705589 |
0.61 |
C1(CCC(CC=1)CN)C(O)=O
|
|
MCULE-5964682653 |
0.61 |
C1/C(/C([C@@H](O)C[C@@H]1O)=C)=C/C=C1\CCC[C@]2(C)[C@@H]([C@@H](CC(=O)O)C)CC[C@]2\1[H]
|
|
MCULE-3957085478 |
0.61 |
C1(C(O)=O)CCC(Br)=CC1
|
|
MCULE-3167433007 |
0.61 |
O=C1C=CC2(C)C3C(O)CC4(C)C(O)(CCC4C3CC(C)C2=C1)C(C)=O
|
|
MCULE-4187073986 |
0.61 |
CCCCCCCCCC/C(/C(=O)O)=C\CC(=O)O
|
|
MCULE-4563413881 |
0.61 |
CC(C(O)=O)(CC1CCCCC=1)N.Cl
|
|
MCULE-7110389607 |
0.61 |
O=C1C=CC2(CCOCC2)CC1
|
|
MCULE-3243112791 |
0.61 |
C(/CC(=O)O)=C(\CCCCCCC=C)/C(=O)O
|
|
MCULE-8374663959 |
0.61 |
C1C(C)C(C(O)=O)(C)C(C(OC)=O)CC=1
|
|
MCULE-1693376379 |
0.61 |
CCC(OC)C(O)C/C=C\C/C=C\CCCCCCCC(=O)O
|
|
MCULE-1249084285 |
0.61 |
C(/CC(=O)O)=C(\CCCCCCCCC=C)/C(=O)O
|
|
MCULE-4854708910 |
0.61 |
CC1(C(=O)C(CC2CC=CCC2)CO1)C
|
|
MCULE-9998858745 |
0.61 |
C1(/C=C/C=C/CCC)C(CO)C(C(=O)O)(O)C(O)C1
|
|
MCULE-2652266780 |
0.61 |
C(C=CCCCCCCCC(=O)OCCCC)[C@H](O)CCCCCC
|
|
MCULE-5920047196 |
0.61 |
C(=O)(O)C(CO)C(O)CCCCC(C)C/C(=C/C(/C)=C/C(=O)O)/C
|
|
MCULE-6259433997 |
0.61 |
CCCCCCCC/C(/C(=O)O)=C/CC(=O)O
|
|
MCULE-2887956476 |
0.61 |
C12(C)CCC3C(CC=C4CC(CCC34C)OC(C)=O)C1CCC2(O)C(C)=O
|
|
MCULE-6943417160 |
0.61 |
C12(CC3CC(CC(C3)C1)C2)C(=O)OC1CCC2(C(=CCC3C2CCC2(C3CCC2CCCCCCCC)C)C1)C
|
|
MCULE-9783531925 |
0.61 |
C12(C)CCC(CC1=CCC1C2CCC2(C1CCC2CCCCCCCC)C)OC(CCCCCCC)=O
|
|
MCULE-1292912968 |
0.61 |
[C@]12(C)CCC3[C@@]([H])(CCC4=C[C@@H](O)CC[C@]34C)C1CC[C@@]2(C(C)=O)OC(C)=O
|
|
MCULE-7277178316 |
0.61 |
[C@@]12([H])CC=C3C[C@@H](OC(=O)CCCCCC)CC[C@]3(C)[C@@]1([H])CC[C@]1(C)[C@H](CC[C@@]21[H])[C@H](C)CCCC(C)C
|
|
MCULE-7699673107 |
0.61 |
C1(OC(=O)CCCCCCCCCCCCCCCCC)CCC2(C)C3CCC4(C)C(C(CCCC(C)C)C)CCC4C3CC=C2C1
|
|
MCULE-1992456011 |
0.61 |
[C@]12(C)CCC(C=C1[C@H](C[C@@]1([H])C3[C@@](C)([C@](CC3)(C(C)=O)OC(C)=O)CCC12)C)=O
|
|
MCULE-4593875674 |
0.61 |
[C@@]12([H])CC=C3C[C@@H](OC(=O)CCCCCCCCC)CC[C@]3(C)[C@@]1([H])CC[C@]1(C)[C@H](CC[C@@]21[H])[C@H](C)CCCC(C)C
|
|
MCULE-8608886418 |
0.61 |
C12(C)CCC(CC1=CCC1C2CCC2(C1CCC2CCCCCCCC)C)OC(CCCCCCCC)=O
|
|
MCULE-9783163200 |
0.61 |
[Na+].C1CC2(C)C3CCC4(C)C(C([O-])=O)CCC4C3CC=C2CC1OC(=O)C
|
|
MCULE-3568637165 |
0.61 |
C12(C)CCC3C(CC=C4CC(CCC34C)OC(CCCCCCCCC)=O)C1CCC2C(C)CCCC(C)C
|
|
MCULE-7520151391 |
0.61 |
C1CC2(C)C3CCC4(C)C(C(OC5CCCCC5)=O)CCC4C3CC=C2CC1OC(=O)C
|
|
MCULE-4139907319 |
0.61 |
C12(C)CCC(CC1=CCC1C2CCC2(C1CCC2CCCCCCCC)C)OC(CCCCCCCCC)=O
|
|
MCULE-2895344878 |
0.61 |
C(C)(=O)OC1CCC2(C)C3CCC4(C)C(CCC4C3C=C2C1)=O
|
|
MCULE-1361205448 |
0.61 |
C12(C)CCC(CC1=CCC1C2CCC2(C1CCC2CCCCCCCC)C)OC(CCC1CCCCC1)=O
|
|
MCULE-7973895970 |
0.61 |
C1C[C@]2(C)[C@@]3([H])CC[C@]4(C)[C@@]([H])([C@@H](CC[C@@H](CC)C(C)C)C)CC[C@@]4([H])[C@]3([H])CC=C2C[C@H]1OC(=O)CCCCCCCCCCCCCCC
|
|
MCULE-5520472136 |
0.61 |
C12(C)CCC3C(CC=C4CC(CCC34C)OC(C)=O)C1CC(C)C2(O)C(C)=O
|
|
MCULE-3951215552 |
0.61 |
[C@@]12([H])CC=C3C[C@@H](OC(=O)CCCCCCC/C=C\CCCCCCCC)CC[C@]3(C)[C@@]1([H])CC[C@]1(C)[C@H](CC[C@@]21[H])[C@H](C)CCCC(C)C
|
|
MCULE-7572819806 |
0.61 |
CCCCCCCCCCCCCCCCC(O[C@]1(CC[C@@]2(C)C(C1)=CC[C@@]1([C@@]2(CC[C@@]2(C)[C@]1(CC[C@@]2([C@](C)(CCCC(C)C)[H])[H])[H])[H])[H])[H])=O
|
|
MCULE-9599193894 |
0.61 |
C1(=O)C=C2[C@](C)(CC1)[C@]1([H])[C@]([H])([C@@]3([H])[C@@](CC1)(C)[C@@H](C(=O)COC(C)=O)CC3)CC2
|
|
MCULE-1955355747 |
0.61 |
C12(C)CCC3C(CCC4=CC(=O)CCC34C)C1CC[C@@]2(C(C)=O)OC(C)=O
|
|
MCULE-6581533408 |
0.61 |
C12(C)CCC(CC1=CCC1C2CCC2(C1CCC2CCCCCCCC)C)OC(CCCCCC)=O
|
|
MCULE-8057071681 |
0.61 |
C12(C)CCC(CC1=CCC1C2CCC2(C1CCC2CCCCCCCC)C)OC(CCCCC)=O
|
|
MCULE-7551134886 |
0.61 |
[C@]12(C)CCC(CC1=CCC1C2CC[C@]2(C1CCC2=O)C)OC(CCCCCC)=O
|
|
MCULE-1675088199 |
0.61 |
C12(C)CCC3C(CC=C4CC(CCC34C)OC(CCCCCCC)=O)C1CCC2C(C)CCCC(C)C
|
|
MCULE-9107883806 |
0.61 |
C12(C)CCC3(C([H])(CCC4=CC(=O)CCC34C)C1([H])CCC2C(=O)COC(C)=O)[H]
|
|
MCULE-4073913947 |
0.61 |
C12(C)C(C(C)=O)CCC1([H])C1(C([H])(C(OC(C)=O)C2)C2(C)CCC(C=C2CC1)=O)[H]
|
|
MCULE-1525311774 |
0.61 |
Cl.[C@@H]1(C(O)=O)[C@H](N)[C@]2(C[C@]1([H])C=C2)[H]
|
|
MCULE-4016604549 |
0.61 |
C12(C)CCC(CC1=CCC1C2CCC2(C1CCC2=O)C)OC(CCCCCC)=O
|
|
MCULE-8036810785 |
0.61 |
[C@]12(C)CC[C@]3([C@@]([H])(CCC4=CC(=O)CC[C@]34C)[C@]1([H])CC[C@@H]2C(=O)COC(C)=O)[H]
|
|
MCULE-6900103591 |
0.61 |
C1CC2(C)C3C=CC4=C(C(CC(O)C(O)C(O)(C)C)C)C(=O)CC4(C)C3(C)CCC2C(C)(C)C1=O
|
|
MCULE-9956647861 |
0.61 |
C12(C)CCC(CC1=CCC1C2CCC2(C1CCC2CCCCCCCC)C)OC(C1CCCC1)=O
|
|
MCULE-9770266464 |
0.61 |
C12(C)CCC3C(CC=C4CC(CCC34C)OC(CCCCCCCC=CCCCCCCCC)=O)C1CCC2C(C)CCCC(C)C
|
|
MCULE-5475024726 |
0.61 |
[C@@H]1(OC(=O)CCCCCCCCCCCCCCCCCCCCC)CC2[C@](C)(CC1)[C@]1([H])[C@]([H])([C@@]3([H])[C@@](CC1)(C)[C@@H]([C@H](C)CCCC(C)C)CC3)CC=2
|
|
MCULE-3429789050 |
0.61 |
[C@]12(C)CC[C@]3([C@@]([H])(CCC4=CC(=O)CC[C@]34C)[C@]1([H])CC[C@@]2(C(C)=O)OC(C)=O)[H]
|
|
MCULE-9767686096 |
0.61 |
C[C@]12CC[C@H](OC(=O)CCCCCCCCCCCCC)CC1=CC[C@@]1([H])[C@]3([H])CC[C@]([H])([C@H](C)CCCC(C)C)[C@@]3(C)CC[C@]21[H]
|
|
MCULE-8977795489 |
0.61 |
CCCCCCCCCCCCCC(O[C@]1(CC[C@@]2(C)C(C1)=CC[C@@]1([C@@]2(CC[C@@]2(C)[C@]1(CC[C@@]2([C@](C)(CCCC(C)C)[H])[H])[H])[H])[H])[H])=O
|
|
MCULE-1588785943 |
0.61 |
CCCCCCCCCCCC(O[C@]1(CC[C@@]2(C)C(C1)=CC[C@@]1([C@@]2(CC[C@@]2(C)[C@]1(CC[C@@]2([C@](C)(CCCC(C)C)[H])[H])[H])[H])[H])[H])=O
|
|
MCULE-8252955604 |
0.61 |
[C@]12(C)CC[C@@H](CC1=CCC1C2CC[C@]2(C1CCC2CCCCCCCC)C)OC(CCCCCCCCCCCCC)=O
|
|
MCULE-2831209997 |
0.61 |
[C@]12([H])CC[C@]3(C)C(CC[C@@]3([H])[C@]1([H])CC=C1C[C@@H](OC(=O)CCCCCC)CC[C@]21C)=O
|
|
MCULE-3401105479 |
0.61 |
C1CC2(C(=O)O)C3(O)CCC(C)(C=C)C=C3C(=O)CC2C(C)(C)C1
|
|
MCULE-8794665540 |
0.61 |
[C@]12(C)CCC(C=C1[C@H](C[C@@]1([H])[C@]3([C@@](C)([C@](CC3)(C(C)=O)OC(C)=O)CC[C@@]12[H])[H])C)=O
|
|
MCULE-4759733755 |
0.61 |
[C@]12(C)CCC3[C@@]([H])(CC=C4C[C@@H](CC[C@]34C)OC(C)=O)C1C[C@@H](C)[C@]2(O)C(C)=O
|
|
MCULE-2983937435 |
0.61 |
[C@]12(C)CC[C@]3([C@@]([H])(CC=C4C[C@H](CC[C@]34C)OC(C)=O)C1C[C@H](O)[C@]2([H])C(C)=O)[H]
|
|
MCULE-2730494737 |
0.61 |
C12(CCC3(C4(CCC(CC4=CCC3(C1(CCC2([H])C(C)CCCC(C)C)[H])[H])OC(=O)CCCCCCCCCCCCCCC)C)[H])C
|
|
MCULE-6883610361 |
0.61 |
[C@]12(C)CC[C@@H](CC1=CCC1C2CC[C@]2(C1CCC2CCCCCCCC)C)OC(CCCCCCCCCCCCCCC)=O
|
|
MCULE-6594306024 |
0.61 |
C12(C)CCC3C(CC=C4CC(CCC34C)OC(CCC3CCCCC3)=O)C1CCC2C(C)CCCC(C)C
|
|
MCULE-1102900161 |
0.61 |
[C@]1(Cl)(CC2CC1C=C2)C(O)=O
|
|
MCULE-1526124264 |
0.61 |
[C@]12(C)CC[C@@H](CC1=CCC1C2CC[C@]2(C1CCC2CCCCCCCC)C)OC(CC1CCCCC1)=O
|
|
MCULE-8461996452 |
0.61 |
C12(C)CCC3C(CC=C4CC(CCC34C)OC(CCCCCC)=O)C1CCC2C(C)CCCC(C)C
|
|
MCULE-1257490890 |
0.61 |
C12(C)CCC(CC1=CCC1C2CCC2(C1CCC2CCCCCCCC)C)OC(CCCCCCCCCCCC)=O
|
|
MCULE-5476020058 |
0.61 |
C12(CCC3(C4(CCC(OC(CCCCCCCCCCC)=O)CC4=CCC3(C1(CCC2C(C)CCCC(C)C)[H])[H])C)[H])C
|
|
MCULE-3263354032 |
0.61 |
C12(C)CCC3C(CC=C4CC(CCC34C)OC(CCCCCCCCCCCCC)=O)C1CCC2C(C)CCCC(C)C
|
|
MCULE-1928835025 |
0.61 |
C12(C)CCC3C(CC=C4CC(CCC34C)OC(CCCCCCCCCC)=O)C1CCC2C(C)CCCC(C)C
|
|
MCULE-9543309945 |
0.61 |
C12(C)CCC3C4(C)CCC(OC(=O)C)CC4=CCC3C1CCC2C(=O)OC1CC2CCC1C2
|
|
MCULE-7000169771 |
0.61 |
[C@]12(C)CC[C@@H](CC1=CCC1C2CC[C@]2(C1CCC2CCCCCCCC)C)OC(CCCCCCCCC)=O
|
|
MCULE-1900297968 |
0.61 |
C12(C)CCC(CC1=CCC1C2CCC2(C1CCC2CCCCCCCC)C)OC(CCCCCCCCCCC)=O
|
|
MCULE-3569475442 |
0.61 |
C12(C)CCC3C(CC=C4CC(CCC34C)OC(CCCCCCCC)=O)C1CCC2C(C)CCCC(C)C
|
|
MCULE-1091492885 |
0.61 |
[C@@]12([H])CC=C3C[C@@H](OC(=O)CCCCC)CC[C@]3(C)[C@@]1([H])CC[C@]1(C)[C@H](CC[C@@]21[H])[C@H](C)CCCC(C)C
|
|
MCULE-3557825189 |
0.61 |
C12(C)CCC3C(CC=C4CC(CCC34C)OC(C3CCCC3)=O)C1CCC2C(C)CCCC(C)C
|
|
MCULE-6929994718 |
0.61 |
[C@]12(C)CC[C@@H](CC1=CCC1C2CC[C@]2(C1CCC2CCCCCCCC)C)OC(CCCCCCCCCCC)=O
|
|
MCULE-7271710617 |
0.61 |
[C@]12(C)CC[C@@H](CC1=CCC1C2CC[C@]2(C1CCC2CCCCCCCC)C)OC(CCCCCCCCCC)=O
|
|
MCULE-3362097880 |
0.61 |
[C@]12(C)CC[C@@H](CC1=CC[C@]1([H])[C@]2([H])CC[C@]2([C@@]1([H])CC[C@@H]2CCCCCCCC)C)OC(CCCCCC)=O
|
|
MCULE-9987906336 |
0.61 |
CC(CCC[C@H]([C@@H]1[C@]2(C)[C@@]([C@]3([C@@](CC2)([H])[C@]2(C)C(C[C@H](CC2)OC(=O)CCCCCCCCCCCCCCC)=CC3)[H])([H])CC1)C)C
|
|
MCULE-4195671425 |
0.61 |
Cl.C1(C(O)=O)C(N)C2CC1C=C2
|
|
MCULE-5265419450 |
0.61 |
C12(C)CCC(CC1=CCC1C2CCC2(C1CCC2CCCCCCCC)C)OC(CCCCCCCCCCCCC)=O
|
|
MCULE-3397065732 |
0.61 |
[C@@]12(C)C(C(C)=O)CCC1C1C([C@H](OC(C)=O)C2)[C@@]2(C)CCC(C=C2CC1)=O
|
|
MCULE-8816644358 |
0.61 |
C12(C)CCC3C(CC=C4CC(CCC34C)OC(C)=O)C1CC[C@]2(O)C(C)=O
|
|
MCULE-3268211483 |
0.61 |
CC(=O)[C@@]1([C@]2(C)[C@@]([C@]3([C@@](CC2)([H])[C@]2(C)C(=CC(=O)CC2)[C@@H](C)C3)[H])([H])CC1)OC(=O)C
|
|
MCULE-4894890520 |
0.61 |
C12(C)CCC3(C4(C)CCC(OC(CCCCCCCCCCCC=CCCCCCCCC)=O)CC4=CCC3([H])C1(CCC2C(C)CCCC(C)C)[H])[H]
|
|
MCULE-5451000624 |
0.61 |
C12(C)CCC(CC1=CCC1C2CCC2(C1CCC2CCCCCCCC)C)OC(CCCCCCCCCC)=O
|
|
MCULE-4487426289 |
0.61 |
CC(CCC[C@H]([C@@H]1[C@]2(C)[C@@]([C@]3([C@@](CC2)([H])[C@]2(C)C(C[C@H](CC2)OC(=O)CCCCCCCCCCCCCCC)=CC3)[H])([H])CC1)C)C
|
|
MCULE-6785867509 |
0.61 |
[C@]12([C@]([H])(CC[C@]3(C)[C@H](CC[C@@]13[H])[C@H](C)CCCC(C)C)[C@@]1(C)CC[C@H](OC(=O)CCCCCCCC)CC1=CC2)[H]
|
|
MCULE-7300055150 |
0.61 |
[C@]12(C)CC[C@@H](CC1=CC[C@]1([H])[C@]2([H])CC[C@]2([C@@]1([H])CC[C@@H]2CCCCCCCC)C)OC(CCCCCCCC)=O
|
|
MCULE-1587965499 |
0.61 |
[C@]12(C)CC[C@@H](CC1=CC[C@]1([H])[C@]2([H])CC[C@]2([C@@]1([H])CC[C@@H]2CCCCCCCC)C)OC(CCCCCCCCCCCCC)=O
|
|
MCULE-4683482437 |
0.61 |
C1(=O)CCC2(C)C3CCC4(C)C(OC(=O)C)(C(=O)C)CCC4C3CCC2=C1
|
|
MCULE-8572432727 |
0.61 |
[C@]12(C)CC[C@@H](CC1=CC[C@]1([H])[C@]2([H])CC[C@]2([C@@]1([H])CC[C@@H]2CCCCCCCC)C)OC(C1CCCC1)=O
|
|
MCULE-6654749941 |
0.61 |
[C@]12(C)CC[C@@H](CC1=CC[C@]1([H])[C@]2([H])CC[C@]2([C@@]1([H])CC[C@@H]2CCCCCCCC)C)OC(CCCCC)=O
|
|
MCULE-7560687727 |
0.61 |
[C@@]12([H])CC=C3C[C@H](CC[C@]3(C)[C@@]1([H])CC[C@]1(C)[C@H](CC[C@@]21[H])[C@H](C)CCCC(C)C)OC(=O)CCCCCCCC=CCCCCCCCC
|
|
MCULE-3632686303 |
0.61 |
[C@]12(C)CC[C@@H](CC1=CC[C@]1([H])[C@]2([H])CC[C@]2([C@@]1([H])CC[C@@H]2CCCCCCCC)C)OC(CCCCCCCCCCC)=O
|
|
MCULE-7313126879 |
0.61 |
C12(C)CCC(CC1=CCC1C2CCC2(C1CCC2CCCCCCCC)C)OC(CC1CCCCC1)=O
|
|
MCULE-1286036245 |
0.61 |
[C@]12([C@]([H])(CC[C@]3(C)[C@H](CC[C@@]13[H])[C@H](C)CCCC(C)C)[C@@]1(C)CC[C@H](OC(=O)CCCCCCC)CC1=CC2)[H]
|
|
MCULE-3582226231 |
0.61 |
[C@]12(C)CC[C@@H](CC1=CC[C@]1([H])[C@]2([H])CC[C@]2([C@@]1([H])CC[C@@H]2CCCCCCCC)C)OC(CCC1CCCCC1)=O
|
|
MCULE-5268900721 |
0.61 |
[C@]12(C)CC[C@@H](CC1=CCC1C2CC[C@]2(C1CCC2CCCCCCCC)C)OC(CCCCCCC)=O
|
|
MCULE-1849472820 |
0.61 |
C12(C)CCC(C=C1C(CC1C3C(C)(C(CC3)(C(C)=O)OC(C)=O)CCC12)C)=O
|
|
MCULE-2808257085 |
0.61 |
C(C)(=O)OC1CCC2(COC(C)=O)C3CCC4(C)C(CCC4C3CC=C2C1)C(OCC)=O
|
|
MCULE-4311810496 |
0.61 |
[C@]12(C)CC[C@@H](CC1=CCC1C2CC[C@]2(C1CCC2CCCCCCCC)C)OC(CCCCCCCCCCCC)=O
|
|
MCULE-8308803305 |
0.61 |
C1=CCC(CO)([H])C(CO)([H])C1
|
|
MCULE-7060414091 |
0.61 |
OCC1(CC=CC1)CC1CCCCC1
|
|
MCULE-2186753253 |
0.61 |
C1(CCC=CC1)(CO)CO
|
|
MCULE-6794880716 |
0.61 |
C/C(/C)=C/C(C1CCC2(CC2)CC1)O
|
|
MCULE-2184969189 |
0.61 |
OCC1(CC2C(C2)C1)CC1CC=CC1
|
|
MCULE-4834307131 |
0.61 |
OC(C1(CCCC1)O)CC1CC=CC1
|
|
MCULE-4398307489 |
0.61 |
C/C(/C)=C/C1(C(C2CC2)CCCC1)O
|
|
MCULE-4829210533 |
0.61 |
C/C(/C)=C/C1(CCC2(CC2)CC1)O
|
|
MCULE-9061110786 |
0.61 |
C(=C(/C)\C)\C(=O)C1CCC(CC1)=O
|
|
MCULE-5351377157 |
0.61 |
C/C(/C)=C/CCC1(C2CC(CC2)C1)O
|
|
MCULE-6700435672 |
0.61 |
C1CC(CO)(C([H])(CO)CC=1)C
|
|
MCULE-4914569425 |
0.61 |
C1CC(C)(CO)C(C)(CO)CC=1
|
|
MCULE-6673315997 |
0.61 |
C/C(/C)=C/C1(C2(CCCCC2)CC1)O
|
|
MCULE-1567541702 |
0.61 |
C1C=CCC(CO)(CO)C1C
|
|
MCULE-9207728452 |
0.61 |
CC1(C2CCC3(C4(C)C(C5C(CC4)(C)CCC(C(=O)O)(C)C5)=CC(=O)C3C2(C)CCC1OC(CCC(=O)O)=O)C)C
|
|
MCULE-8776636782 |
0.61 |
C1CC23C(=O)OC(=O)C2(CCCC3)CC=1
|
|
MCULE-4359391178 |
0.61 |
C12(C)CCC3C(CC=C4CC(CCC34C)OC(C)=O)C1CC1([H])CC=CCC21C(C)=O
|
|
MCULE-9103372368 |
0.61 |
C1(=O)C2C3CCC(C=C3)C2C(=O)O1
|
|
MCULE-8868589151 |
0.61 |
C1(C)CC23CCCCC2(C(=O)OC3=O)CC=1
|
|
MCULE-5454494701 |
0.61 |
C123CCC4C(C)(CCCC4(C)C(O)=O)C1CC(C1C(OC(=O)C21)=O)C(C(C)C)=C3
|
|
MCULE-8026671401 |
0.61 |
CC1(C(=O)CC[C@@]2(C)[C@H]1C[C@@H](C1[C@@]3(C)[C@]([C@@H]([C@@H](CC(C[C@H](C(=O)O)C)=O)C)C[C@@H]3O)(C)[C@H](O)C(=O)C=12)O)C
|
|
MCULE-2122490766 |
0.61 |
C1CC23CCCCC2(C(=O)OC3=O)C2CCCCC=12
|
|
MCULE-5053755296 |
0.61 |
C1(C)CC23CCCCC2(C(=O)OC3=O)CC=1C
|
|
MCULE-1252077735 |
0.61 |
C1CC23CC(=O)OC(=O)C2(CCCC3)CC=1
|
|
MCULE-2234048518 |
0.61 |
CC1([C@H](CC[C@@]2([C@]3(C(=O)C=C4[C@@](C)(CC[C@]5(C)[C@@]4([H])C[C@@](C)(C(=O)[O-])CC5)[C@]3(C)CC[C@@]12[H])[H])C)OC(=O)CCC(=O)[O-])C
|
|
MCULE-8234847813 |
0.61 |
[C@]12([H])C(=O)C=C3[C@]4([H])C[C@@](CC[C@@]4(CC[C@@]3(C)[C@]1(C)CC[C@@]1([H])C(C)(C)[C@H](CC[C@]21C)OC(=O)CCC([O-])=O)C)(C)C([O-])=O
|
|
MCULE-8457539977 |
0.61 |
C(C)(=O)OC1CCC2(C)C3C(CC4(C)C(CCC4C=3CCC2(C1)[H])OC(C)=O)=O
|
|
MCULE-1087443932 |
0.61 |
C1CC2C3C(=O)OC(=O)C3C3CCCCC3=C2CC1
|
|
MCULE-1387113476 |
0.61 |
C12CCC(O)C=C1CCCC2O
|
|
MCULE-2454891288 |
0.61 |
C12(C)CCC(C=C1CCCC2=O)=O
|
|
MCULE-7102510254 |
0.61 |
CC1(C)C(=O)CCC2(C)C1CC(O)C13C(=O)C(=C)C(C1O)CCC32
|
|
MCULE-7068613182 |
0.61 |
[H]C12CC(OC)CCC1(C)C1C(O)CC3(C)C(C(C)C=CC(C)C(C)C)CCC3C1=CC2
|
|
MCULE-3710984096 |
0.61 |
C1CC2(C)C3CCC4(C)C(C(/C=C/C(C(O)C)C(C)C)C)CCC4C3C(O)C=C2CC1O
|
|
MCULE-5394370706 |
0.61 |
C12CCCC(=O)[C@@]1(C)CCC(=O)C=2C
|
|
MCULE-9038016383 |
0.61 |
C1C[C@]2(C)[C@@]3([H])CC[C@]4(C)[C@@]([H])([C@@H](CC[C@@H](CC)C(C)C)C)CC[C@@]4([H])[C@]3([H])[C@H](O)C=C2C[C@H]1O
|
|
MCULE-3983794608 |
0.61 |
OC1C(=O)CCC=1CC
|
|
MCULE-3803033906 |
0.61 |
[C@]12(C)CCC(C=C1CCCC2=O)=O
|
|
MCULE-6029934866 |
0.61 |
CC(CCC[C@H]([C@@H]1[C@]2(C)[C@@]([C@]3([C@@](CC2)([H])[C@]2(C)C([C@@H]([C@H](CC2)O)O)=CC3)[H])([H])CC1)C)C
|
|
MCULE-2038225383 |
0.61 |
C1C[C@]2(C)[C@@]3([H])CC[C@]4(C)[C@@]([H])([C@@H](CCCC(C)C)C)CC[C@@]4([H])[C@]3([H])CC=C2[C@@H](O)[C@H]1O
|
|
MCULE-9297462921 |
0.61 |
C12(C)CCC(O)C=C1CCCC2O
|
|
MCULE-4574679606 |
0.61 |
[C@@]123C(=O)C(=C)[C@H](CC[C@@]1([H])[C@]1(C)CCC(=O)C(C)(C)[C@@]1([H])C[C@H]2O)[C@H]3O
|
|
MolPort-035-706-344 |
0.61 |
C[C@H](\C=C\CC(C)(C)O)[C@H]1CC[C@@]2(C)[C@@H]3CC[C@@H]4[C@]5(C[C@@]35CC[C@]12C)CC[C@H](O)C4(C)C
|
|
MolPort-045-971-977 |
0.61 |
CC1(C)C2CC=C(CO)CC12
|
|
MolPort-046-203-126 |
0.61 |
O=C1CC2(CCCCC2)C=C1
|
|
MolPort-019-995-875 |
0.61 |
COC(=O)CCCC(C)=C
|
|
MolPort-002-506-988 |
0.61 |
CC1=CC(=O)CC(C)(C)C1=O
|
|
MolPort-002-507-045 |
0.61 |
COC(=O)CCCCCCCC=C
|
|
MolPort-046-153-723 |
0.61 |
CC1(C)[C@@H]2CCC(CO)=C[C@H]12
|
|
MolPort-003-913-461 |
0.61 |
O=C1CC2CCCCC2=C1
|
|
MolPort-000-712-098 |
0.61 |
COC(=O)CCCCCCCCC=C
|
|
MolPort-005-909-575 |
0.61 |
COC(=O)C12CCC(C1C1CCC3[C@@]4(C)C\C(=C\O)C(=O)C(C)(C)C4CC[C@@]3(C)[C@]1(C)CC2)C(C)=C
|
|
MolPort-001-741-158 |
0.61 |
CC(C)=CCC\C(=C/CC\C(C)=C\CC\C(CO)=C\CO)C(O)=O
|
|
MolPort-038-387-359 |
0.61 |
N[C@H]1\C=C/CCCC[C@H]1C(O)=O.N[C@@H]1\C=C/CCCC[C@@H]1C(O)=O
|
|
MolPort-046-688-988 |
0.61 |
C[C@H](CC(O)=O)[C@H]1CC[C@H]2\C(CCC[C@]12C)=C/C=C1\C[C@@H](O)C[C@H](O)C1=C
|
|
MolPort-038-387-510 |
0.61 |
N[C@@H]1\C=C/CCCC[C@@H]1C(O)=O
|
|
MolPort-042-675-409 |
0.61 |
CCC(OC)C(O)C\C=C/C\C=C/CCCCCCCC(O)=O
|
|
MolPort-039-338-129 |
0.61 |
C[C@H](CC\C=C(/C)C(O)=O)[C@H]1CC[C@@]2(C)C3=CCC4C(C)(C)[C@@H](O)CC[C@]4(C)C3=CC[C@]12C
|
|
MolPort-042-675-201 |
0.61 |
OC(=O)C\C=C(\CCCCCCC=C)C(O)=O
|
|
MolPort-039-338-148 |
0.61 |
C[C@H](CC\C=C(/C)C(O)=O)[C@H]1CC[C@@]2(C)C3=CCC4C(C)(C)C(=O)CC[C@]4(C)C3=CC[C@]12C
|
|
MolPort-021-804-545 |
0.61 |
OC(=O)C\C=C(\CCCCCCCCC=C)C(O)=O
|
|
MolPort-039-338-333 |
0.61 |
C[C@H](CC\C=C(\C)C(O)=O)[C@H]1CC[C@@]2(C)C3=CCC4C(C)(C)C(=O)CC[C@]4(C)C3=CC[C@]12C
|
|
MolPort-003-958-686 |
0.61 |
CCCCCCCC\C=C/CCCCCCCC(=O)OC(CO)CO
|
|
MolPort-023-198-070 |
0.61 |
O=C1CCC2(CCOCC2)C=C1
|
|
MolPort-004-769-219 |
0.61 |
NCC1CCC(=CC1)C(O)=O
|
|
MolPort-046-697-161 |
0.61 |
CCC\C=C\C=C\C1CC(O)C(O)(C1CO)C(O)=O
|
|
MolPort-046-773-942 |
0.61 |
Cl.CC(N)(CC1=CCCCC1)C(O)=O
|
|
MolPort-001-739-668 |
0.61 |
CC(CCCCC(O)C(CO)C(O)=O)C\C(C)=C\C(\C)=C\C(O)=O
|
|
MolPort-001-739-964 |
0.61 |
CCCCCCCCCC\C(=C/CC(O)=O)C(O)=O
|
|
MolPort-021-804-594 |
0.61 |
CCCCCCCC\C(=C\CC(O)=O)C(O)=O
|
|
MolPort-046-588-137 |
0.61 |
CCCCC\C=C/C\C=C/CCCCCCCC(=O)OCCC
|
|
MolPort-005-943-432 |
0.61 |
CC(=O)[C@@]1(O)CC[C@H]2[C@@H]3CCC4=CC(=O)C=C[C@]4(C)[C@H]3[C@@H](O)C[C@]12C
|
|
MolPort-000-790-894 |
0.61 |
CCCCCCCCCCCC(=O)O[C@H]1CC[C@]2(C)C3CC[C@]4(C)C(CCCCCCCC)CCC4C3CC=C2C1
|
|
MolPort-044-830-318 |
0.61 |
CC[C@]12CC[C@H]3[C@@H](C=CC4=CC(=O)CC[C@H]34)[C@@H]1CC[C@@]2(O)C#C
|
|
MolPort-000-830-618 |
0.61 |
CC1CC2C3CCC(OC(C)=O)(C(C)=O)C3(C)CCC2C2(C)CCC(=O)C=C12
|
|
MolPort-003-893-547 |
0.61 |
CCCCCCCCCCCCCCCCCC(=O)O[C@H]1CC[C@]2(C)[C@H]3CC[C@]4(C)[C@H](CC[C@H]4[C@@H]3CC=C2C1)[C@H](C)CCCC(C)C
|
|
MolPort-003-893-546 |
0.61 |
CCCCCCCCCCCCCCCC(=O)O[C@H]1CC[C@]2(C)[C@H]3CC[C@]4(C)[C@H](CC[C@H]4[C@@H]3CC=C2C1)[C@H](C)CCCC(C)C
|
|
MolPort-046-790-391 |
0.61 |
C[C@H](C[C@H](O)[C@@H](O)C(C)(C)O)C1=C2C=C[C@H]3[C@@]4(C)CCC(=O)C(C)(C)[C@@H]4CC[C@]3(C)[C@@]2(C)CC1=O
|
|
MolPort-006-069-075 |
0.61 |
CCCCCC(=O)O[C@H]1CC[C@]2(C)[C@H]3CC[C@]4(C)[C@H](CC[C@H]4[C@@H]3CC=C2C1)[C@H](C)CCCC(C)C
|
|
MolPort-007-980-856 |
0.61 |
C[C@@H]1CC2C3CC=C4CC(CCC4(C)C3CCC2(C)[C@@]1(O)C(C)=O)OC(C)=O
|
|
MolPort-044-755-195 |
0.61 |
CC(=O)O[C@H]1CC[C@]2(C)[C@H]3CC[C@@]4(C)[C@@H](CCC4=O)[C@@H]3C=C2C1
|
|
MolPort-044-755-228 |
0.61 |
CC(=O)O[C@H]1CCC2=C3CC[C@@]4(C)[C@@H](CCC4=O)[C@@H]3C[C@@H](O)[C@]2(C)C1
|
|
MolPort-000-778-228 |
0.61 |
CCCCCCCCCCCCC(=O)O[C@H]1CC[C@]2(C)C3CC[C@]4(C)C(CCCCCCCC)CCC4C3CC=C2C1
|
|
MolPort-044-649-785 |
0.61 |
COC(=O)[C@]12CC[C@@H](C)[C@H](C)[C@H]1C1=CC(=O)[C@@H]3[C@@]4(C)CC[C@H](OC(C)=O)C(C)(C)[C@@H]4CC[C@@]3(C)[C@]1(C)CC2
|
|
MolPort-003-855-546 |
0.61 |
CCCCCCCCCCCCCC(=O)OC1CCC2(C)C3CCC4(C)C(CCCCCCCC)CCC4C3CC=C2C1
|
|
MolPort-003-855-540 |
0.61 |
CCCCCCCCCC(=O)OC1CCC2(C)C3CCC4(C)C(CCCCCCCC)CCC4C3CC=C2C1
|
|
MolPort-001-593-439 |
0.61 |
CCCCCCC(=O)OC1CC[C@]2(C)C3CC[C@@]4(C)C(CCC4=O)C3CC=C2C1
|
|
MolPort-000-836-412 |
0.61 |
CC(=O)OC1CC[C@]2(C)C3CC[C@@]4(C)C(CC[C@]4(O)C(C)=O)C3CC=C2C1
|
|
MolPort-035-706-294 |
0.61 |
CCCCCCCCCCCCCCCC(=O)O[C@H]1CC[C@]2(C)[C@H]3CC[C@]4(C)[C@H](CC[C@H]4[C@@H]3CC=C2C1)[C@H](C)CC[C@@H](CC)C(C)C
|
|
MolPort-039-339-048 |
0.61 |
C[C@H](CC(=O)CC(C)C(O)=O)[C@H]1CC(=O)[C@@]2(C)C3=C(C(=O)[C@@H](O)[C@]12C)[C@@]1(C)CCC(=O)C(C)(C)C1CC3=O
|
|
MolPort-003-855-530 |
0.61 |
CCCCCCCCC1CCC2C3CC=C4CC(CCC4(C)C3CCC12C)OC(=O)CCCCC
|
|
MolPort-017-262-822 |
0.61 |
Cl.N[C@@H]1[C@H]2C[C@H](C=C2)[C@@H]1C(O)=O
|
|
MolPort-000-758-136 |
0.61 |
CCCCCCCCCCCCCC(=O)O[C@H]1CC[C@]2(C)C3CC[C@]4(C)C(CCCCCCCC)CCC4C3CC=C2C1
|
|
MolPort-000-767-609 |
0.61 |
CCCCCCCCCCCCCCCC(=O)O[C@H]1CC[C@]2(C)C3CC[C@]4(C)C(CCCCCCCC)CCC4C3CC=C2C1
|
|
MolPort-008-346-684 |
0.61 |
CCCCCCCCC1CCC2C3CC=C4C[C@H](CC[C@]4(C)C3CC[C@]12C)OC(=O)C12CC3C[C@@H](CC(C3)C1)C2
|
|
MolPort-006-124-217 |
0.61 |
CCCCCCC(=O)O[C@H]1CC[C@]2(C)[C@H]3CC[C@@]4(C)[C@@H](CCC4=O)[C@@H]3CC=C2C1
|
|
MolPort-003-928-863 |
0.61 |
CCCCCCCC\C=C/CCCCCCCC(=O)O[C@H]1CC[C@]2(C)[C@H]3CC[C@]4(C)[C@H](CC[C@H]4[C@@H]3CC=C2C1)[C@H](C)CCCC(C)C
|
|
MolPort-000-795-108 |
0.61 |
CCCCCCCCCCC(=O)O[C@H]1CC[C@]2(C)C3CC[C@]4(C)C(CCCCCCCC)CCC4C3CC=C2C1
|
|
MolPort-042-646-612 |
0.61 |
CCCCCCCCC1CCC2C3CC=C4C[C@H](CC[C@]4(C)C3CC[C@]12C)OC(=O)CCC1CCCCC1
|
|
MolPort-000-295-010 |
0.61 |
CCCCCCCCCCCCCCCCCC(=O)OC1CCC2(C)C3CCC4(C)C(CCC4C3CC=C2C1)C(C)CCCC(C)C
|
|
MolPort-000-295-004 |
0.61 |
CCCCCCC(=O)OC1CCC2(C)C3CCC4(C)C(CCC4C3CC=C2C1)C(C)CCCC(C)C
|
|
MolPort-000-295-002 |
0.61 |
CCCCCCCCC(=O)OC1CCC2(C)C3CCC4(C)C(CCC4C3CC=C2C1)C(C)CCCC(C)C
|
|
MolPort-046-765-467 |
0.61 |
[2H]C([2H])([2H])[C@H]1C[C@H]2[C@@H]3CC[C@](OC(=O)C([2H])([2H])[2H])(C(C)=O)[C@@]3(C)CC[C@@H]2[C@@]2(C)CCC(=O)C=C12
|
|
MolPort-000-294-998 |
0.61 |
CCCCCCCCCCCCCC(=O)OC1CCC2(C)C3CCC4(C)C(CCC4C3CC=C2C1)C(C)CCCC(C)C
|
|
MolPort-001-740-061 |
0.61 |
CC(=O)OCC(=O)[C@H]1CC[C@H]2[C@@H]3CCC4=CC(=O)CC[C@]4(C)[C@H]3CC[C@]12C
|
|
MolPort-046-765-412 |
0.61 |
CC[C@]12CC[C@@H]3[C@@H](C=CC4=CC(=O)CC[C@H]34)[C@H]1CC[C@]2(O)C#C
|
|
MolPort-000-294-992 |
0.61 |
CCCCCCCCCCC(=O)OC1CCC2(C)C3CCC4(C)C(CCC4C3CC=C2C1)C(C)CCCC(C)C
|
|
MolPort-003-940-763 |
0.61 |
CCCCCCCCCCCCCCCCC(=O)O[C@H]1CC[C@]2(C)[C@H]3CC[C@]4(C)[C@H](CC[C@H]4[C@@H]3CC=C2C1)[C@H](C)CCCC(C)C
|
|
MolPort-000-737-773 |
0.61 |
CC(=O)O[C@@]1(CCC2C3CCC4=CC(=O)CCC4(C)C3CCC12C)C(C)=O
|
|
MolPort-044-830-300 |
0.61 |
C[C@]12CC[C@H]3[C@@H](C=CC4=CC(=O)CC[C@H]34)[C@@H]1CC[C@@]2(O)C#C
|
|
MolPort-006-170-421 |
0.61 |
Cl.N[C@H]1[C@H]2C[C@H](C=C2)[C@H]1C(O)=O
|
|
MolPort-003-940-792 |
0.61 |
CCCCCCCCCCCCCCCCCCCCCC(=O)O[C@H]1CC[C@]2(C)[C@H]3CC[C@]4(C)[C@H](CC[C@H]4[C@@H]3CC=C2C1)[C@H](C)CCCC(C)C
|
|
MolPort-003-855-532 |
0.61 |
CCCCCCCCCCCC(=O)OC1CCC2(C)C3CCC4(C)C(CCCCCCCC)CCC4C3CC=C2C1
|
|
MolPort-003-666-223 |
0.61 |
C[C@H]1CC2C3CC[C@](OC(C)=O)(C(C)=O)[C@@]3(C)CCC2[C@@]2(C)CCC(=O)C=C12
|
|
MolPort-002-526-154 |
0.61 |
C[C@@H]1CC2[C@@H]3CC=C4C[C@@H](CC[C@]4(C)C3CC[C@]2(C)[C@@]1(O)C(C)=O)OC(C)=O
|
|
MolPort-002-810-756 |
0.61 |
CC(C)CCCC(C)C1CCC2C3CC=C4CC(CCC4(C)C3CCC12C)OC(=O)CCC1CCCCC1
|
|
MolPort-002-502-001 |
0.61 |
CCCCCCCCCCCC(=O)O[C@H]1CC[C@]2(C)[C@H]3CC[C@]4(C)[C@H](CC[C@H]4[C@@H]3CC=C2C1)[C@H](C)CCCC(C)C
|
|
MolPort-002-501-660 |
0.61 |
CCCCCCCC(=O)O[C@H]1CC[C@]2(C)[C@H]3CC[C@]4(C)[C@H](CC[C@H]4[C@@H]3CC=C2C1)[C@H](C)CCCC(C)C
|
|
MolPort-002-501-655 |
0.61 |
CCCCCCCCCCCCCC(=O)O[C@H]1CC[C@]2(C)[C@H]3CC[C@]4(C)[C@H](CC[C@H]4[C@@H]3CC=C2C1)[C@H](C)CCCC(C)C
|
|
MolPort-002-501-639 |
0.61 |
CCCCCCC(=O)O[C@H]1CC[C@]2(C)[C@H]3CC[C@]4(C)[C@H](CC[C@H]4[C@@H]3CC=C2C1)[C@H](C)CCCC(C)C
|
|
MolPort-001-785-923 |
0.61 |
CC(=O)OCC(=O)C1CCC2C3CCC4=CC(=O)CCC4(C)C3CCC12C
|
|
MolPort-002-501-638 |
0.61 |
CCCCCCCC\C=C\CCCCCCCC(=O)O[C@H]1CC[C@]2(C)[C@H]3CC[C@]4(C)[C@H](CC[C@H]4[C@@H]3CC=C2C1)[C@H](C)CCCC(C)C
|
|
MolPort-002-501-637 |
0.61 |
CCCCCCCCCC(=O)O[C@H]1CC[C@]2(C)[C@H]3CC[C@]4(C)[C@H](CC[C@H]4[C@@H]3CC=C2C1)[C@H](C)CCCC(C)C
|
|
MolPort-003-855-519 |
0.61 |
CCCCCCCCC1CCC2C3CC=C4CC(CCC4(C)C3CCC12C)OC(=O)CCCCCCCC
|
|
MolPort-002-527-421 |
0.61 |
CC(=O)O[C@@]1(CCC2[C@@H]3CCC4=C[C@@H](O)CC[C@]4(C)C3CC[C@]12C)C(C)=O
|
|
MolPort-002-510-983 |
0.61 |
COC(=O)CC1(C)OC2CCCCC2C2C=CCCC12
|
|
MolPort-002-510-995 |
0.61 |
C[C@]12CC=C3C(CCC4=CC(=O)CC[C@]34C)C1CC[C@]2(O)C#N
|
|
MolPort-002-319-532 |
0.61 |
CC(=O)OC1CCC2(C)C3CCC4(C)C(CC[C@]4(O)C(C)=O)C3CC=C2C1
|
|
MolPort-002-511-119 |
0.61 |
CCCCCCCCC1CCC2C3CC=C4C[C@H](CC[C@]4(C)C3CC[C@]12C)OC(=O)CCCCCCC
|
|
MolPort-002-530-244 |
0.61 |
CCCCCCCC[C@H]1CC[C@H]2[C@@H]3CC=C4C[C@H](CC[C@]4(C)[C@H]3CC[C@]12C)OC(=O)CCCCC
|
|
MolPort-016-578-938 |
0.61 |
CCCCCCCC\C=C/CCCCCCCC(=O)O[C@H]1CC[C@]2(C)C3CC[C@]4(C)C(CCC4C3CC=C2C1)[C@H](C)CCCC(C)C
|
|
MolPort-002-530-234 |
0.61 |
CCCCCCCC[C@H]1CC[C@H]2[C@@H]3CC=C4C[C@H](CC[C@]4(C)[C@H]3CC[C@]12C)OC(=O)C1CCCC1
|
|
MolPort-002-530-141 |
0.61 |
CCCCCCCCCCCCCC(=O)O[C@H]1CC[C@]2(C)[C@H]3CC[C@]4(C)[C@@H](CCCCCCCC)CC[C@H]4[C@@H]3CC=C2C1
|
|
MolPort-002-529-701 |
0.61 |
CCCCCCCC[C@H]1CC[C@H]2[C@@H]3CC=C4C[C@H](CC[C@]4(C)[C@H]3CC[C@]12C)OC(=O)CCCCCCCC
|
|
MolPort-046-596-236 |
0.61 |
CC(=O)O[C@@]1(CCC2C3CCC4=CC(O)CC[C@]4(C)C3CC[C@]12C)C(C)=O
|
|
MolPort-002-520-707 |
0.61 |
CC(=O)O[C@@]1(CCC2[C@@H]3CCC4=CC(=O)CC[C@]4(C)C3CC[C@]12C)C(C)=O
|
|
MolPort-046-594-655 |
0.61 |
CCCCCCCCC1CCC2C3CC=C4CC(CCC4(C)C3CCC12C)OC(=O)C12CC3CC(CC(C3)C1)C2
|
|
MolPort-028-610-213 |
0.61 |
CC(CC(O)C(O)C(C)(C)O)C1=C2C=CC3C4(C)CCC(=O)C(C)(C)C4CCC3(C)C2(C)CC1=O
|
|
MolPort-002-529-036 |
0.61 |
CCCCCCCCCCCC(=O)O[C@H]1CC[C@]2(C)[C@H]3CC[C@]4(C)[C@@H](CCCCCCCC)CC[C@H]4[C@@H]3CC=C2C1
|
|
MolPort-002-528-936 |
0.61 |
CCCCCCCC[C@H]1CC[C@H]2[C@@H]3CC=C4C[C@H](CC[C@]4(C)[C@H]3CC[C@]12C)OC(=O)CCC1CCCCC1
|
|
MolPort-046-594-654 |
0.61 |
CCCCCCCCC1CCC2C3CC=C4CC(CCC4(C)C3CCC12C)OC(=O)CCC1CCCCC1
|
|
MolPort-001-793-906 |
0.61 |
CCCCCCCCC(=O)O[C@H]1CC[C@]2(C)[C@H]3CC[C@]4(C)[C@H](CC[C@H]4[C@@H]3CC=C2C1)[C@H](C)CCCC(C)C
|
|
MolPort-001-794-638 |
0.61 |
C[C@H]1C[C@H]2[C@@H]3CC[C@](OC(C)=O)(C(C)=O)[C@@]3(C)CC[C@@H]2[C@@]2(C)CCC(=O)C=C12
|
|
MolPort-046-689-349 |
0.61 |
CC(=O)O[C@]1(CC[C@H]2[C@@H]3CCC4=CC(=O)CC[C@@H]4[C@H]3CC[C@]12C)C(C)=O
|
|
MolPort-002-507-115 |
0.61 |
CC(=O)O[C@@]1(CC[C@H]2[C@@H]3CCC4=CC(=O)CC[C@]4(C)[C@H]3CC[C@]12C)C(C)=O
|
|
MolPort-003-855-514 |
0.61 |
CCCCCCCCC1CCC2C3CC=C4CC(CCC4(C)C3CCC12C)OC(=O)C1CCCC1
|
|
MolPort-003-855-505 |
0.61 |
CCCCCCCCCCCCC(=O)OC1CCC2(C)C3CCC4(C)C(CCCCCCCC)CCC4C3CC=C2C1
|
|
MolPort-003-855-503 |
0.61 |
CCCCCCCCC1CCC2C3CC=C4CC(CCC4(C)C3CCC12C)OC(=O)CC1CCCCC1
|
|
MolPort-003-855-497 |
0.61 |
CCCCCCCCCCC(=O)OC1CCC2(C)C3CCC4(C)C(CCCCCCCC)CCC4C3CC=C2C1
|
|
MolPort-003-855-492 |
0.61 |
CCCCCCCCC1CCC2C3CC=C4CC(CCC4(C)C3CCC12C)OC(=O)CCCCCCC
|
|
MolPort-046-764-456 |
0.61 |
CC[C@]12CC[C@H]3[C@@H](C[C@@H](O)C4=CC(=O)CC[C@H]34)[C@@H]1C=C[C@@]2(O)C#C
|
|
MolPort-003-855-484 |
0.61 |
CCCCCCCCC1CCC2C3CC=C4CC(CCC4(C)C3CCC12C)OC(=O)CCCCCC
|
|
MolPort-035-868-714 |
0.61 |
CC(O)=O.C[C@H]1C[C@H]2[C@@H]3CC[C@](OC(C)=O)(C(C)=O)[C@@]3(C)CC[C@@H]2[C@@]2(C)CCC(=O)C=C12
|
|
MolPort-001-932-114 |
0.61 |
CC(=O)OC1(CCC2C3CCC4=CC(=O)CCC4(C)C3CCC12C)C(C)=O
|
|
MolPort-002-507-129 |
0.61 |
CC(=O)O[C@H]1CC[C@]2(C)C3CC[C@@]4(C)C(CC[C@]4(O)C(C)=O)[C@@H]3CC=C2C1
|
|
MolPort-046-596-340 |
0.61 |
C[C@@H]1CC2C3CC=C4CC(CC[C@]4(C)C3CC[C@]2(C)[C@@]1(O)C(C)=O)OC(C)=O
|
|
MolPort-003-721-672 |
0.61 |
CC(C)CCCC(C)C1CCC2C3CC=C4CC(CCC4(C)C3CCC12C)OC(=O)C1CCCC1
|
|
MolPort-003-710-687 |
0.61 |
CC(C)CCCC(C)C1CCC2C3CC=C4CC(CCC4(C)C3CCC12C)OC(=O)C12CC3CC(CC(C3)C1)C2
|
|
MolPort-003-698-895 |
0.61 |
OC(=O)[C@@]1(Cl)CC2CC1C=C2
|
|
MolPort-002-507-374 |
0.61 |
C[C@H]1C[C@H]2C3CC[C@](OC(C)=O)(C(C)=O)[C@@]3(C)CCC2[C@@]2(C)CCC(=O)C=C12
|
|
MolPort-003-388-177 |
0.61 |
CCCCCCC(=O)OC1CCC2(C)C3CCC4(C)C(CCC4=O)C3CC=C2C1
|
|
MolPort-001-742-758 |
0.61 |
CC1(C)CCCC2(C1CC(=O)C1=CC(C)(CCC21O)C=C)C(O)=O
|
|
MolPort-002-510-031 |
0.61 |
CCCCCCCCCC(=O)O[C@H]1CC[C@]2(C)C3CC[C@]4(C)C(CCCCCCCC)CCC4C3CC=C2C1
|
|
MolPort-002-911-094 |
0.61 |
CC(=O)OC1CCC2(C)C3CCC4(C)C(CCC4C(=O)OC4CC5CCC4C5)C3CC=C2C1
|
|
MolPort-002-510-156 |
0.61 |
CCCCCCCCC1CCC2C3CC=C4C[C@H](CC[C@]4(C)C3CC[C@]12C)OC(=O)CC1CCCCC1
|
|
MolPort-002-510-316 |
0.61 |
CC(=O)O[C@@H]1C[C@@]2(C)C(CCC2C(C)=O)C2CCC3=CC(=O)CC[C@]3(C)C12
|
|
MolPort-027-847-790 |
0.61 |
CCCCCCCCC1CCC2C3CC=C4C[C@H](CC[C@]4(C)C3CC[C@]12C)OC(=O)CCCCCCCC
|
|
MolPort-002-528-527 |
0.61 |
CCCCCCCC[C@H]1CC[C@H]2[C@@H]3CC=C4C[C@H](CC[C@]4(C)[C@H]3CC[C@]12C)OC(=O)CCCCCC
|
|
MolPort-009-199-732 |
0.61 |
OC(=O)CC1(CCC1)C=C
|
|
MolPort-002-525-771 |
0.61 |
CC(O)CC\C=C(/C)CC[C@@H]1C(=C)CCC2C(C)(C)CCC[C@@]12C
|
|
MolPort-038-346-950 |
0.61 |
OC(=O)C(=C)C1CCC1
|
|
MolPort-000-834-214 |
0.61 |
CC(=O)CC\C=C(/C)CCC1C(=C)CCC2C(C)(C)CCCC12C
|
|
MolPort-004-748-423 |
0.61 |
CC(C)=CC(=O)C1CCC(=O)CC1
|
|
MolPort-035-706-357 |
0.61 |
CC(C)=CCC[C@](C)(O)[C@H]1CC[C@]2(C)[C@@H]1CC[C@@H]1[C@@]3(C)CC[C@H](O)C(C)(C)[C@@H]3CC[C@@]21C
|
|
MolPort-000-738-187 |
0.61 |
CC(=O)CC\C=C(/C)CCC1C(=C)CCC2C(C)(C)CCC[C@@]12C
|
|
MolPort-002-498-934 |
0.61 |
OCC1(CO)CCC=CC1
|
|
MolPort-022-364-567 |
0.61 |
O=CC1CCCC=C1
|
|
MolPort-001-782-917 |
0.61 |
OCC1CCCC=C1
|
|
MolPort-009-019-049 |
0.60 |
CCCCC\C=C/C\C=C/C\C=C/CCCC\C=C/CCC(O)=O
|
|
MolPort-046-689-748 |
0.60 |
CC[C@]12CC[C@H]3[C@@H](CCC4=CCCC[C@H]34)[C@@H]1CC[C@@]2(O)C#C
|
|
MolPort-006-069-078 |
0.60 |
C[C@]12CC[C@H]3[C@@H](CCC4=CCCC[C@H]34)[C@@H]1CC[C@@]2(O)C#C
|
|
MolPort-006-185-012 |
0.60 |
C[C@@]12CC[C@@H]3[C@H](CCC4=CCCC[C@@H]34)[C@H]1CC[C@]2(O)C#C
|
|
MolPort-006-668-581 |
0.60 |
CC1(C)CCCC2(C)C(CO)C(CO)=CCC12
|
|
MolPort-006-822-493 |
0.60 |
CC1(C)CCC[C@@]2(C)[C@H]1CC=C(C=O)[C@@H]2C=O
|
|
MolPort-000-709-129 |
0.60 |
CC1(C)C2CCC(C2)(C(O)=O)\C1=C\Br
|
|
MolPort-044-561-988 |
0.60 |
CCCCC\C=C/C\C=C/C\C=C/C\C=C/C\C=C/CCC(O)=O
|
|
MolPort-001-742-406 |
0.60 |
COC(=O)[C@]1(C)CCC[C@@]2(C)C3CC[C@@H]4C[C@]3(CC4=C)CCC12
|
|
MolPort-046-147-057 |
0.60 |
CC(=C)[C@H]1CC(C)=C(C)C(=O)C1
|
|
MolPort-000-824-500 |
0.60 |
CCCCCCCCCC(=O)OC1CC[C@@]2(C)[C@@H](CCC3C4CC=C(C(C)=O)[C@@]4(C)CCC23)C1
|
|
MolPort-046-697-151 |
0.60 |
CC1(C)CC2C=C(C(CC(O)=O)C2(C1)C(=O)CO)C(O)=O
|
|
MolPort-002-529-465 |
0.60 |
CCCCCCCCCC(=O)O[C@H]1CC[C@@]2(C)[C@@H](CC[C@H]3[C@@H]4CC=C(C(C)=O)[C@@]4(C)CC[C@H]23)C1
|
|
MolPort-039-138-993 |
0.60 |
CCCCC[C@H](O)\C=C\[C@H]1C=CC(=O)[C@H]1C\C=C/CCCC(O)=O
|
|
MolPort-002-530-517 |
0.60 |
CCCCCC(=O)O[C@H]1CC[C@@]2(C)[C@@H](CC[C@H]3[C@@H]4CC=C(C(C)=O)[C@@]4(C)CC[C@H]23)C1
|
|
MolPort-002-514-937 |
0.60 |
CCCC(=O)OC1CC[C@@]2(C)[C@@H](CCC3C4CC=C(C(C)=O)[C@@]4(C)CCC23)C1
|
|
MolPort-046-765-694 |
0.60 |
C[C@H]1C[C@H]2C3CC[C@](O)(C(O)=O)[C@@]3(C)C[C@H](O)C2[C@@]2(C)C=CC(=O)C=C12
|
|
MolPort-044-755-193 |
0.60 |
CC(=O)O[C@H]1CC[C@H]2[C@@H]3CCC4=CCCC[C@]4(C)[C@H]3CC[C@]12C
|
|
MolPort-046-596-485 |
0.60 |
CC(C)CCC(=O)OC1CC[C@@]2(C)[C@@H](CCC3C4CC=C(C(C)=O)[C@@]4(C)CCC23)C1
|
|
MolPort-046-596-558 |
0.60 |
CCCCCC(=O)OC1CC[C@@]2(C)[C@@H](CCC3C4CC=C(C(C)=O)[C@@]4(C)CCC23)C1
|
|
MolPort-046-761-554 |
0.60 |
COC1=C(C[C@@]2(C)[C@@H](CC[C@H]3[C@@H]4CC[C@](C)(O)[C@@]4(C)CC[C@H]23)C1)C=O
|
|
MolPort-003-939-181 |
0.60 |
CCCCC[C@H](O)\C=C\[C@H]1C=CC(=O)[C@@H]1C\C=C/CCCC(O)=O
|
|
MolPort-046-203-184 |
0.60 |
OC(=O)C1CCC=C1C=O
|
|
MolPort-044-183-171 |
0.60 |
CCCCC(C)(C)[C@H](O)\C=C\[C@H]1C=CC(=O)[C@@H]1C\C=C/CCCC(O)=O
|
|
MolPort-039-138-874 |
0.60 |
CCCCC[C@@](C)(O)\C=C\[C@H]1C=CC(=O)[C@@H]1C\C=C/CCCC(O)=O
|
|
MolPort-002-526-459 |
0.60 |
C[C@]12C[C@H](O)C3[C@@H](CCC4=CC(=O)C=C[C@]34C)C1CC[C@]2(O)C(O)=O
|
|
MolPort-002-525-983 |
0.60 |
CC(C)CCC(=O)O[C@@H]1CC[C@@]2(C)[C@@H](CC[C@H]3C4CC=C(C(C)=O)[C@@]4(C)CCC23)C1
|
|
MolPort-006-106-573 |
0.60 |
[Na+].[Na+].CC1(C)[C@H](CC[C@@]2(C)[C@H]1CC[C@]1(C)[C@@H]2C(=O)C=C2[C@@H]3C[C@](C)(CC[C@]3(C)CC[C@@]12C)C([O-])=O)OC(=O)CCC([O-])=O
|
|
MolPort-046-596-261 |
0.60 |
C[C@@H]1CC2C3CC[C@H]4CC(=O)CC[C@]4(C)C3=CC[C@]2(C)[C@@]1(O)C(=O)COC(C)=O
|
|
MolPort-035-706-364 |
0.60 |
CC(C)=CCC[C@@H]1[C@@H]2[C@H](C[C@]3(C)C4=CC(=O)[C@H]5C(C)(C)[C@@H](O)CC[C@]5(C)[C@H]4CC[C@@]23C)OC1=O
|
|
MolPort-046-761-598 |
0.60 |
[Na+].[Na+].CC1(C)[C@H](CC[C@@]2(C)[C@@H]1CC[C@]1(C)[C@H]2C(=O)C=C2[C@@H]3C[C@@](C)(CC[C@]3(C)CC[C@]12C)C([O-])=O)OC(=O)CCC([O-])=O
|
|
MolPort-009-015-246 |
0.60 |
COC(=O)CC[C@]1(C)[C@H]2CCC[C@H]3COC[C@@]23C(=O)C=C1C
|
|
MolPort-002-510-498 |
0.60 |
C[C@@H]1CC2[C@@H]3CC[C@H]4CC(=O)CC[C@]4(C)C3=CC[C@]2(C)[C@@]1(O)C(=O)COC(C)=O
|
|
MolPort-039-338-282 |
0.60 |
CC(C)=CCC[C@@H]1[C@@H]2[C@H](C[C@]3(C)C4=CC(=O)[C@H]5C(C)(C)[C@H](O)CC[C@]5(C)[C@H]4CC[C@@]23C)OC1=O
|
|
MolPort-005-933-646 |
0.60 |
[Na+].[Na+].CC1(C)C(CCC2(C)C1CCC1(C)C2C(=O)C=C2C3CC(C)(CCC3(C)CCC12C)C([O-])=O)OC(=O)CCC([O-])=O
|
|
MolPort-046-156-417 |
0.60 |
C[C@@]12C[C@@H](OC1=O)[C@]1(C)CC[C@]3(C)C(=CC(=O)[C@@H]4[C@@]5(C)CC[C@H](O)C(C)(C)[C@@H]5CC[C@@]34C)[C@@H]1C2
|
|
MolPort-010-969-194 |
0.60 |
CC1CC2C3CCC4CC(=O)CCC4(C)C3=CCC2(C)C1(O)C(=O)COC(C)=O
|
|
MolPort-009-019-145 |
0.60 |
CCCCCC(O)\C=C\[C@@H]1C(C\C=C/CCCC(=O)OC)C(O)CC1=O
|
|
MolPort-002-800-312 |
0.60 |
COC(=O)C1=C(C2CCC1CC2)C(=O)OC
|
|
MolPort-035-706-373 |
0.60 |
CCC(=O)[C@@H]1C[C@@H](C)[C@]2(CC[C@@]3(C)C4=C(CC[C@]23C)[C@@]2(C)CC[C@H](O)[C@](C)(CO)[C@@H]2CC4)O1
|
|
MolPort-046-683-048 |
0.60 |
N[C@H]1CC=CC[C@H]1C(O)=O.N[C@@H]1CC=CC[C@@H]1C(O)=O
|
|
MolPort-002-507-829 |
0.60 |
CCC(=O)OC1C[C@@H]2C[C@H]1[C@H]1CC=C[C@@H]21
|
|
MolPort-003-845-967 |
0.60 |
C[C@H](CCO)CCC=C(C)C
|
|
MolPort-023-312-565 |
0.60 |
C[C@]12CCC3C(CC=C4CC(O)CC[C@]34C)C1CC[C@@]21CO1
|
|
MolPort-035-775-540 |
0.60 |
OC1CCC=CCCC=CCCC1O
|
|
MolPort-002-509-911 |
0.60 |
CC(=O)[C@@]12O[C@]1(C)CC1C3CC=C4CC(O)CC[C@]4(C)C3CC[C@]21C
|
|
MolPort-038-386-044 |
0.60 |
CC1CCC2(C)CCC3(C)C(=CCC4C5(C)CCC(OC(C)=O)C(C)(C5CCC34C)C(O)=O)C2C1C
|
|
MolPort-039-239-671 |
0.60 |
CC(CCC=C(C)C)C(C)C=O
|
|
MolPort-027-640-870 |
0.60 |
CCCCC[C@H](O)\C=C\[C@H]1[C@H](O)CC(=O)[C@@H]1C\C=C/CCCC(=O)OC
|
|
MolPort-003-926-743 |
0.60 |
O=C1CCCCC=C1
|
|
MolPort-001-769-687 |
0.60 |
CC(CCO)CCC=C(C)C
|
|
MolPort-027-853-592 |
0.60 |
CC(=O)O[C@@H]1C[C@@]2(C)C(CC[C@]3(C)C2CC=C2C4CC(C)(C)CC[C@@]4(CC[C@@]32C)C(O)=O)C(C)(C)[C@H]1O
|
|
MolPort-000-707-481 |
0.60 |
CC(=O)[C@@]12O[C@@H]1CC1C3CC=C4CC(O)CCC4(C)C3CCC21C
|
|
MolPort-002-506-867 |
0.60 |
CC(=O)[C@@]12O[C@@H]1C[C@H]1[C@@H]3CC=C4C[C@@H](O)CC[C@]4(C)[C@H]3CC[C@]21C
|
|
MolPort-007-980-841 |
0.60 |
CC(=O)[C@@]12CC3C4CC=C5CC(O)CCC5(C)C4CCC3(C)[C@@H]1O2
|
|
MolPort-044-183-228 |
0.60 |
CCCCC\C=C\C=C1/[C@@H](C\C=C/CCCC(O)=O)[C@@H](O)CC1=O
|
|
MolPort-046-761-013 |
0.60 |
CC1(C)CC[C@H](O)[C@@]2(C)[C@@H]3C[C@H](O)[C@@H]4[C@@H](O)[C@@]3([C@H](O)C[C@H]12)C(=O)C4=C
|
|
MolPort-002-525-601 |
0.60 |
CC(=O)[C@@]12O[C@@H]1CC1[C@@H]3CC=C4C[C@H](O)CC[C@]4(C)C3CC[C@]21C
|
|
MolPort-039-052-455 |
0.60 |
CC(C)C(=C)CC[C@@H](C)[C@H]1[C@@H](O)C[C@H]2[C@@H]3[C@H](O)C=C4C[C@@H](O)CC[C@]4(C)[C@H]3CC[C@]12C
|
|
MolPort-002-521-192 |
0.60 |
C[C@]12CCC3[C@@H](CCC4=CC(=O)CC[C@]34C=O)C1CCC2=O
|
|
MolPort-002-054-032 |
0.60 |
N[C@@H]1CC=CC[C@H]1C(O)=O
|
|
MolPort-002-054-031 |
0.60 |
N[C@H]1CC=CC[C@H]1C(O)=O
|
|
MolPort-002-527-432 |
0.60 |
CC(=O)[C@@]12O[C@@H]1CC1[C@@H]3CC=C4C[C@@H](O)CC[C@]4(C)C3CC[C@]21C
|
|
MolPort-035-705-882 |
0.60 |
CC1(C)CC[C@H](O)[C@@]2(C)[C@@H]3CC[C@@H]4[C@@H](O)[C@@]3([C@H](O)C[C@H]12)C(=O)C4=C
|
|
MolPort-046-511-053 |
0.60 |
C[C@@H]1[C@@H]2C=CC[C@@H]2C1=O
|
|
MolPort-035-705-668 |
0.60 |
C[C@@H]([C@H]1[C@@H](O)C[C@@]2(C)[C@@H]3CC[C@@H]4[C@]5(C[C@@]35CC[C@]12C)C=CC(=O)C4(C)C)N(C)C
|
|
MolPort-039-338-184 |
0.60 |
CC[C@H](CC[C@@H](C)[C@H]1[C@@H](O)C[C@H]2[C@@H]3[C@H](O)C=C4C[C@@H](O)CC[C@]4(C)[C@H]3CC[C@]12C)C(C)C
|
|
MolPort-004-831-228 |
0.60 |
C\C=C\C(=O)C1C(C)C=CCC1(C)C
|
|
MolPort-004-778-510 |
0.60 |
N[C@@H]1CC=CC[C@@H]1C(O)=O
|
|
MolPort-003-958-863 |
0.60 |
CC(=O)[C@@]12O[C@]1(C)C[C@H]1[C@@H]3CC=C4C[C@@H](O)CC[C@]4(C)[C@H]3CC[C@]21C
|
|
MolPort-046-701-801 |
0.60 |
[NH3+][C@@H]1CC=CC[C@@H]1C([O-])=O
|
|
MolPort-009-756-326 |
0.60 |
CC(C)[C@@]1(O)CCC(C)=CC1
|
|
MolPort-003-960-163 |
0.60 |
CC\C=C/CCCCO
|
|
MolPort-001-836-053 |
0.60 |
C[C@]12CCC3C(CCC4=CC(=O)CC[C@]34C=O)C1CCC2=O
|
|
MolPort-046-593-467 |
0.60 |
O[C@H]1CC\C=C/CC\C=C/CC[C@H]1O
|
|
MolPort-001-793-058 |
0.60 |
C[C@H](CCC=C(C)C)CC=O
|
|
MolPort-001-740-430 |
0.60 |
CC\C=C/C\C=C/C=C/[C@H](O)CCCCCCCC(O)=O
|
|
MolPort-003-938-611 |
0.60 |
O=C1C[C@H]2C=CC[C@@H]12
|
|
MolPort-001-787-552 |
0.60 |
CC(CCC=C(C)C)CC=O
|
|
MolPort-002-535-711 |
0.60 |
C[C@@H](CCO)CCC=C(C)C
|
|
MolPort-020-858-906 |
0.60 |
O=CC1=CCCCCC1
|
|
MolPort-001-512-553 |
0.60 |
CC(=O)C12OC1CC1C3CC=C4CC(O)CCC4(C)C3CCC21C
|
|
MolPort-002-354-437 |
0.60 |
CC12CCC3C(CC=C4CC(O)CCC34C)C1CCC2N
|
|
MolPort-046-791-199 |
0.60 |
OC(=O)C1CC(C1)=C1CCC1
|
|
MolPort-003-938-563 |
0.60 |
O=C1C[C@@H]2C=CC[C@H]12
|
|
MolPort-044-198-364 |
0.60 |
OC(=O)[C@@H]1CC=CC[C@H]1C(F)(F)F
|
|
MolPort-001-792-412 |
0.60 |
C[C@@H](CCC=C(C)C)CC=O
|
|
MolPort-005-944-607 |
0.60 |
CC1C=CC2CCCCC2C1CCC1CC(O)CC(=O)O1
|
|
MolPort-002-511-286 |
0.60 |
CC(O)C(C)CCC=C(C)C
|
|
MolPort-046-793-320 |
0.60 |
CC(=O)O[C@H]1CC[C@@]2(C)C(CC[C@]3(C)[C@H]2CC=C2[C@@H]4CC(C)(C)CC[C@]4(C)CC[C@]32C)[C@@]1(C)C(O)=O
|
|
MolPort-001-790-441 |
0.60 |
O=C1CC2C=CCC12
|
|
MolPort-021-804-563 |
0.60 |
CC(=O)OC1CCC2(C)C(CCC3(C)C2CC=C2C4CC(C)(C)CCC4(C)CCC32C)C1(C)C(O)=O
|
|
MolPort-002-529-126 |
0.60 |
CCC(=O)OC1C[C@@H]2C[C@H]1C1CC=CC21
|
|
MolPort-005-938-309 |
0.60 |
C[C@]12CC[C@H]3[C@@H](CC(=C)C4=CC(=O)CC[C@]34C)[C@@H]1CCC2=O
|
|
MolPort-046-158-414 |
0.60 |
CC(C)CCCC(C)CCCC(C)CCC\C(C)=C\CC(CO)C(=C)CCCC(C)CCCC(C)CCCC(C)C
|
|
MolPort-020-005-949 |
0.60 |
C[C@@H]1CC[C@]2(C)CC[C@]3(C)C(=CC[C@@H]4[C@@]5(C)CC[C@@H](OC(C)=O)[C@@](C)([C@@H]5CC[C@@]34C)C(O)=O)[C@@H]2[C@H]1C
|
|
MolPort-006-122-262 |
0.60 |
CCC(=O)OC1CC2CC1C1CC=CC21
|
|
MolPort-001-740-480 |
0.60 |
COC(=O)\C=C(/C)CC[C@H]1C(=C)CCC2[C@]1(C)CCC[C@]2(C)C(O)=O
|
|
MolPort-006-121-317 |
0.60 |
CCOC(=O)C1CCC=CC1
|
|
MolPort-046-596-330 |
0.60 |
CC(=O)[C@@]12CC3C4CC=C5CC(O)CC[C@]5(C)C4CC[C@]3(C)[C@@H]1O2
|
|
MolPort-020-005-947 |
0.60 |
CC(=O)O[C@@H]1CC[C@@]2(C)[C@@H](CC[C@]3(C)[C@@H]2CC=C2[C@@H]4CC(C)(C)CC[C@]4(C)CC[C@@]32C)[C@@]1(C)C(O)=O
|
|
MolPort-046-792-980 |
0.60 |
CCCCCC\C=C1\CCCC1=O
|
|
MolPort-000-693-048 |
0.60 |
[Na+].CC12C=C(Br)C1CCC2(C)C([O-])=O
|
|
MolPort-003-959-981 |
0.60 |
CC(C)C1(O)CCC(C)=CC1
|
|
MCULE-5591099284 |
0.60 |
[C@]12(C(C)=O)[C@H](O1)C[C@@]1([H])[C@]3([C@]([H])(CC[C@]21C)[C@@]1(C)CC[C@@H](CC1=CC3)O)[H]
|
|
MCULE-3946157075 |
0.60 |
C(/C)(\C)=C/CC[C@@H](C)CCO
|
|
MCULE-9968407696 |
0.60 |
OC(C=C1C(=O)C2(CCCCC2)CC1)=O
|
|
MCULE-3619310950 |
0.60 |
[C@]12(C=O)CCC(C=C1CC[C@]1([H])C2CC[C@]2(C1CCC2=O)C)=O
|
|
MCULE-2204393281 |
0.60 |
C1C2CC2CCCC([H])(O)C=1
|
|
MCULE-2407386794 |
0.60 |
[C@@H](C)(CCO)CC/C=C(\C)/C
|
|
MCULE-6674224748 |
0.60 |
C[C@@]12C(=O)CC[C@]1([C@]1([C@@](CC2)([H])[C@]2(C)C(=CC(=O)CC2)C(=C)C1)[H])[H]
|
|
MCULE-3213163274 |
0.60 |
COC1C(C2(C(O)=O)CC=CC2)CCC1
|
|
MCULE-2091190347 |
0.60 |
OC(C1(OCCC1)CC1CC=CCC1)=O
|
|
MCULE-1210480263 |
0.60 |
C1CC(C(=O)OCC)CCC=1
|
|
MCULE-2243940623 |
0.60 |
C1CC2CC2CCC(=O)C=1
|
|
MCULE-4966336591 |
0.60 |
C12(C(C)=O)CC3C(C)(CCC4C3CC=C3C4(C)CCC(O)C3)C1O2
|
|
MCULE-8602502307 |
0.60 |
CC1(C)C2CC(O)C34C(=O)C(=C)C(C3O)CCC4C2(CO)C(O)CC1
|
|
MCULE-7115760688 |
0.60 |
OC(C1C2(CC2)C1)CC1CCCC=1
|
|
MCULE-6649407342 |
0.60 |
C12(C(C)=O)C(O1)CC1C3C(CCC21C)C1(C)CCC(CC1=CC3)O
|
|
MCULE-4399439382 |
0.60 |
C(/C)(\C)=C/CC[C@@H](C)CCO
|
|
MCULE-7421072365 |
0.60 |
C12C3C4C5C1C(C1C5C5C4C(CC5C1=O)C3=O)C=C2
|
|
MCULE-2423386096 |
0.60 |
O=C(C1C2(CC2)C1)CC1CCCC=1
|
|
MCULE-3583239018 |
0.60 |
O=C1CCC2(C)C3CCC4(C)C(CCC4C3CC(=C)C2=C1)OC(C)=O
|
|
MCULE-3353701926 |
0.60 |
O1C2C1C1CC2C2C1C(C=CC2=O)=O
|
|
MCULE-5800803041 |
0.60 |
C1CCCC23C(=O)OC(=O)C2(CC=CC3)CCCCC1
|
|
MCULE-4899690160 |
0.60 |
C[C@]12CC[C@]3([H])[C@]4(CCC(=O)C=C4[C@@H]4C[C@@H]4[C@@]3([H])[C@]1([H])[C@@H]1C[C@@H]1[C@]12CCC(=O)O1)C
|
|
MCULE-1100298898 |
0.60 |
C12=CC(=O)[C@]3([C@](C)(C[C@H]([C@@H](O)C3)O)C1CC[C@]1(C)C(CC[C@@]21O)[C@@](C)(O)[C@H](O)CCC(C)(C)O)O
|
|
MCULE-1124925533 |
0.60 |
C1(C)CC23CCCCCCCCCC2(C(=O)OC3=O)CC=1
|
|
MCULE-5491138764 |
0.60 |
C1(=O)C2C(C)C=C(CC2C(=O)O1)C
|
|
MCULE-3344154059 |
0.60 |
O=C1CCC2(C3C(CC4(C)C(CCC4C3CCC2=C1)OC(C)=O)OC(C)=O)[H]
|
|
MCULE-7236722260 |
0.60 |
C12CCC3=CC(C(=C)CC3(C)C1CCC1(C)[C@@](CCC21)(C)OC(=O)C)=O
|
|
MCULE-5641241273 |
0.60 |
O=C1C2C3C=CC(CCCC3)C2C(=O)O1
|
|
MCULE-7602245034 |
0.60 |
C12C3C4C5C6C3(C(OC)=O)C3(C(=O)OC(CC1)C2C34)C5C1CC=CC61
|
|
MCULE-2024719526 |
0.60 |
C1[C@@]2(C)[C@@]([H])(CC[C@@]3(C)[C@]4(C)CC[C@@]5(C(O)=O)CCC(C)(C)C[C@@]5([H])[C@@]4([H])C(=O)C=C23)C(C)(C)C(=O)C=1C#N
|
|
MCULE-1244370752 |
0.60 |
C1(CC2CC1C=C2)C(OCCCCOC(C1CCC=CC1)=O)=O
|
|
MCULE-9210235948 |
0.60 |
C12CC=C3CC(CCC3(C)C1CCC1(C)C(CCC21)C(C)CCC(=O)OC1CC2CC1C=CC2)O
|
|
MCULE-4498813870 |
0.60 |
CC1(C(=O)C(=C[C@@]2(C3=CC(=O)[C@@]4([H])[C@@](C)(CC[C@]5(C(=O)O)[C@@]4([H])CC(C)(C)CC5)[C@]3(C)CC[C@@]12[H])C)C#N)C
|
|
MCULE-5593960668 |
0.60 |
O=C1CCC2(C)C3C(O)CC4(C)C(CCC4C3CCC2=C1)OC(CC)=O
|
|
MCULE-1945667981 |
0.60 |
C12[C@@](C)(CC[C@@]([H])([C@H](C)C(OC)=O)C1=O)C=CC(=O)C=2C
|
|
MCULE-4625091681 |
0.60 |
C1(=O)C=C2[C@](C)(C=C1)[C@]1([H])[C@]([H])([C@@]3([H])[C@@](CC1=O)(C)[C@@](O)(C(=O)CO)CC3)CC2
|
|
MCULE-2603291254 |
0.60 |
[C@]12(C)CC(=O)[C@]3([C@@]([H])(CCC4=CC(=O)C=C[C@]34C)[C@]1([H])CC[C@]2(O)C(CO)=O)[H]
|
|
MCULE-1733908720 |
0.60 |
CCCCCCCCCCCCOC(CCCCCCCC=CCC=CCCCCC)=O
|
|
MCULE-1910819843 |
0.60 |
COC1C(C(C2CCCCCCC=2)=O)C1
|
|
MCULE-7939545317 |
0.60 |
O=C1C=C[C@@]2([C@]3(C(=O)C[C@@]4(C)[C@](C[C@@H]([C@@]4(C(=O)CO)O)C)([H])[C@]3([H])CCC2=C1)[H])C
|
|
MCULE-6709332090 |
0.60 |
C1(CC2(C=1)CC(=C2)C(O)=O)C(O)=O
|
|
MCULE-5764697777 |
0.60 |
C1=CC2(C)C3C(C4CCC(O)(C(=O)CO)C4(CC3O)C)CC(C)C2=CC1=O
|
|
MCULE-4494327817 |
0.60 |
C1(=O)C=CC2(C)C3C(O)CC4(C)C(O)(C(=O)CO)C(C)CC4C3CCC2=C1
|
|
MCULE-5376882383 |
0.60 |
C[C@@H]1C2=CC(C=C[C@]2(C)[C@@H]2[C@H]([C@H]3[C@](C)(C[C@@H]2O)[C@@](O)(C(CO)=O)CC3)C1)=O
|
|
MCULE-6519818800 |
0.60 |
[C@]12(C)C=CC(C=C1[C@H](C[C@@]1([H])[C@]3([C@@](C)([C@@](CC3)(O)C(CO)=O)C[C@H](O)[C@]21[H])[H])C)=O
|
|
MCULE-8934838036 |
0.60 |
C12(C)C=CC(C=C1[C@H](CC1C3C(C)([C@@](CC3)(O)C(CO)=O)CC(O)C21)C)=O
|
|
MCULE-6066053107 |
0.60 |
COC1C(C(C2CCCCC=2)=O)C1
|
|
MCULE-2907287296 |
0.60 |
C1C(CC2C1(C(C(C(=O)O)=C2)CC(O)=O)C(=O)C)(C)C
|
|
MCULE-7076095662 |
0.60 |
O=C(C1CCCC1)OCC1CC=CCC1
|
|
MCULE-7117172040 |
0.60 |
C1CCCCCCCCC(C(OC)=O)=C1
|
|
MCULE-4729751323 |
0.60 |
C[C@@H]1[C@@](C(CO)=O)(O)[C@]2(C)[C@H]([C@H]3[C@H](C(C2)=O)[C@]2(C)C(=CC(C=C2)=O)CC3)C1
|
|
MCULE-9427838644 |
0.60 |
C12(C)CC(=O)C3C(CCC4=CC(=O)C=CC34C)C1CCC2(O)C(CO)=O
|
|
MCULE-7221814357 |
0.60 |
O=C(C1CCOCC1)CC1CC=CC1
|
|
MCULE-8684927566 |
0.60 |
O=CC1(CCOCC1)CC1CC=CC1
|
|
MCULE-1129581582 |
0.60 |
C=C(CCCCCC(=O)O)Br
|
|
MCULE-2012587344 |
0.60 |
C1=CC2C3C4C5C(C(=O)C(=O)C2C4C=C5)C13
|
|
MCULE-8955106048 |
0.60 |
C1(C)(C)C(=O)C2C(C)(C)C2C=C1
|
|
MCULE-5300332080 |
0.60 |
O=C(C1CCCCCC=1)[C@H]1C[C@@H]2[C@@H](C2)C1
|
|
MCULE-1020785874 |
0.60 |
O=C(C12CCCC1C2)C1CCCCCC=1
|
|
MCULE-1943700997 |
0.60 |
OC(C12CCCC1C2)C1CCCC=1
|
|
MCULE-7221367574 |
0.60 |
O=C(C12CCCC1C2)C1CCCC=1
|
|
MCULE-3997698187 |
0.60 |
C1C[C@]23C[C@@]42CC[C@]2(C)[C@@]([H])([C@@H](C/C=C/C(O)(C)C)C)CC[C@@]2(C)[C@]4([H])CC[C@@]3([H])[C@H](C)[C@H]1O
|
|
MCULE-1852323478 |
0.60 |
CC(C(C#N)(CC1CC=CCC1)C)=O
|
|
MCULE-1373086617 |
0.60 |
O=C(C1CCCC=1)[C@H]1C[C@@H]2[C@@H](C2)C1
|
|
MCULE-6895852201 |
0.60 |
C=C(CCCCCCC(=O)O)Br
|
|
MCULE-7458844213 |
0.60 |
O=C(C1CCCC=1)C1CC2C(C2)CC1
|
|
MCULE-1014005440 |
0.60 |
CCCCCCC(C(O)=O)C(=C)C(=O)O
|
|
MCULE-5809713750 |
0.60 |
[C@@H]1(O)C(=C)CC[C@@H](C(C)C)C=CC(=C)CC1
|
|
MCULE-8680547001 |
0.60 |
C(O)CCCCCC(C(=C)C(O)=O)C(O)=O
|
|
MCULE-5426201745 |
0.60 |
C1/C(=C/CC(=O)CO)/CCCCC1
|
|
MCULE-9014720947 |
0.60 |
OC(C12CCCCC1C2)C1CCCC=1
|
|
MCULE-8316425336 |
0.60 |
O=C(C12CCCCC1C2)C1CCCC=1
|
|
MCULE-2324385738 |
0.60 |
C12(C)C(=O)CC(C)(C)C1C=C2
|
|
MCULE-2913420738 |
0.60 |
C(C)(=C)C1([H])CCC(=CC1)C=O
|
|
MCULE-8543584572 |
0.60 |
C1(=O)C2CC=CC1CC2
|
|
MCULE-2754957448 |
0.60 |
O=C(C1CCCC=1)C1C2C(C2)CCC1
|
|
MCULE-1420218917 |
0.60 |
C(C)(=C)C1CCC(CO)=CC1
|
|
MCULE-8777632906 |
0.60 |
O=C(C1CCCC=1)CC1CC2C(C2)C1
|
|
MCULE-6399251682 |
0.60 |
CC(O)CCCCC(C(=C)C(O)=O)C(O)=O
|
|
MCULE-1467475131 |
0.60 |
C1C=C2CCC(O)C2C1
|
|
MCULE-2144125677 |
0.60 |
C12([H])C=C(C)C1([H])CCC2([H])O
|
|
MCULE-5865441641 |
0.60 |
O=C(C1CCCC=1)CC1CC2C(C2)CC1
|
|
MCULE-1776810440 |
0.60 |
C=C(C)[C@H]1CCC(C=O)=CC1
|
|
MCULE-2280015640 |
0.60 |
C(C)(=C)[C@@]1([H])CCC(=CC1)C=O
|
|
MCULE-8413416808 |
0.60 |
C/C(/C)=C/CCC1(C=CCCC1)O
|
|
MCULE-4943208576 |
0.60 |
C1C[C@@]2([H])[C@]3([H])CC[C@@]4(C)[C@@](O)(C#C)CC[C@]4([H])[C@@]3([H])CCC2=CC1
|
|
MCULE-5554933328 |
0.60 |
CC(C(CC1CC=CCC1)=O)(F)C
|
|
MCULE-4292259193 |
0.60 |
[C@@]12([H])CC[C@@](O)(C#C)[C@@]1(C)CC[C@]1([H])[C@@]3([H])CCCC=C3CC[C@@]21[H]
|
|
MCULE-1732403644 |
0.60 |
OC1(C2C=CC(C2)C1)CCC1CC1
|
|
MCULE-8733365213 |
0.60 |
NC1CC(C(CC2CC=CCC2)O)C1
|
|
MCULE-1540616337 |
0.60 |
O=C1CCC2C1(C)CCC1C2CC=C2C=CCCC21C
|
|
MCULE-9087411700 |
0.60 |
NC(CC1C2C=CC(CC2)C1)CO
|
|
MCULE-6891127079 |
0.60 |
FC(C(CC1CC=CCC1)=O)(F)F
|
|
MCULE-2601245805 |
0.60 |
NC1(C(CC2CC=CCC2)O)CCC1
|
|
MCULE-7937772710 |
0.60 |
NC1(C(CC2CC=CCC2)O)CC1
|
|
MCULE-9207192092 |
0.60 |
NC1C(C(CC2CC=CCC2)=O)CCC1
|
|
MCULE-4801038069 |
0.60 |
NC1CC(C(CC2CC=CCC2)=O)C1
|
|
MCULE-5637237774 |
0.60 |
C12(CCC(C(C)(C)C1=CBr)C2)C(O)=O
|
|
MCULE-4079586755 |
0.60 |
C12CC(C3C(O)C(O)C13)C=C2
|
|
MCULE-1046459546 |
0.60 |
FC(C(CC1CC=CCC1)=O)F
|
|
MCULE-6020017542 |
0.60 |
OC1(C2CCC2)C2C=CC(C2)C1
|
|
MCULE-9134588789 |
0.60 |
NC1(C(CC2CC=CCC2)=O)CCCC1
|
|
MCULE-5002847328 |
0.60 |
[H]C12CCCC=C1CCC1C3CCC(O)(C3(C)CCC21)C#C
|
|
MCULE-9082814536 |
0.60 |
O[C@]1(C#C)CC[C@H]2[C@@H]3CCC4=CCCC[C@@H]4[C@H]3CC[C@@]21C
|
|
MCULE-1925585665 |
0.60 |
NC1(C(CC2CC=CCC2)=O)CC1
|
|
MCULE-4519288897 |
0.60 |
OC1(C2CC2)C2C=CC(C2)C1
|
|
MCULE-7610155056 |
0.60 |
C1CC2(C)C(CO)C(CO)=CCC2C(C)(C)C1
|
|
MCULE-7333041840 |
0.60 |
CC(C(CC1CC=CCC1)=O)(F)F
|
|
MCULE-8434520112 |
0.60 |
OC1(C2C=CC(C2)C1)CC1CC1
|
|
MCULE-8264831774 |
0.60 |
NC1(C(CC2CC=CCC2)=O)CCC1
|
|
MCULE-3768588065 |
0.60 |
C/C(/C)=C/CCC1C(=O)CCOC1
|
|
MCULE-9600703174 |
0.60 |
C(C)(=O)OC1CCC2(C)C3C=CC4(C)C(C(C)CCCOC(C)=O)CCC4C3CCC2(C1)[H]
|
|
MCULE-5578038643 |
0.60 |
O(C1CCC2C1(C)CCC1C2CC=C2CCCCC21C)C(C)=O
|
|
MCULE-4103920893 |
0.60 |
C12C3C(C4(C)C(CC3)CC(OC(C)=O)CC4)CCC=1C(CC2)(C)C
|
|
MCULE-6674544067 |
0.60 |
OC(C1(CC=CC1)CC1CC(F)(F)C1)=O
|
|
MCULE-6914138383 |
0.60 |
[C@]12(C)CCC3[C@@]([H])(CC[C@@]4([H])C[C@@H](CC[C@]34C)OC(CCC(C)C)=O)C1CC=C2C(C)=O
|
|
MCULE-9509535864 |
0.60 |
[C@]12(C)CCC3C(CC[C@@]4([H])CC(CC[C@]34C)OC(CCC)=O)C1CC=C2C(C)=O
|
|
MCULE-9478310264 |
0.60 |
C1=C[C@]2(C(=CC1=O)CCC1[C@]3([H])CC[C@](O)(C(=O)O)[C@]3(CC([C@]21[H])=O)C)C
|
|
MCULE-8899661988 |
0.60 |
O=C(C12COCC1C2)CC1CC=CCC1
|
|
MCULE-8228429125 |
0.60 |
C1C2(C(C=C(C(=O)O)C2CC(O)=O)CC1(C)C)C(=O)CO
|
|
MCULE-7666040130 |
0.60 |
[C@]12(C)CCC3C(CC[C@@]4([H])CC(CC[C@]34C)OC(CCCCCCCCC)=O)C1CC=C2C(C)=O
|
|
MCULE-5860324516 |
0.60 |
C1=C[C@]2(C(=CC1=O)CC[C@@]1([H])[C@]3([H])CC[C@](O)(C(O)=O)[C@@]3(C)C[C@@H]([C@]21[H])O)C
|
|
MCULE-4113416417 |
0.60 |
[C@]12(C)C[C@H](O)C3[C@@]([H])(CCC4=CC(=O)C=C[C@]34C)C1CC[C@]2(O)C(O)=O
|
|
MCULE-1836906318 |
0.60 |
[C@]12(C)CCC3C(CC[C@@]4([H])CC(CC[C@]34C)OC(CCCCC)=O)C1CC=C2C(C)=O
|
|
MCULE-9560150043 |
0.60 |
C1=CCC2(C(C1)(C(OC)=O)CCCC2)C#N
|
|
MCULE-1665605717 |
0.60 |
[Na+].[Na+].CC1([C@H](CC[C@@]2([C@]3(C(=O)C=C4[C@@](C)(CC[C@]5(C)[C@@]4([H])C[C@@](C)(C(=O)[O-])CC5)[C@]3(C)CC[C@@]12[H])[H])C)OC(=O)CCC(=O)[O-])C
|
|
MCULE-7135107425 |
0.60 |
[Na+].[Na+].[C@]12([H])C(=O)C=C3[C@]4([H])C[C@@](CC[C@@]4(CC[C@@]3(C)[C@]1(C)CC[C@@]1([H])C(C)(C)[C@H](CC[C@]21C)OC(=O)CCC([O-])=O)C)(C)C([O-])=O
|
|
MCULE-1191180792 |
0.60 |
C(C)(=O)OC1CCC2(C)C3C(CC4(C)C(CCC4C3CC=C2C1)=O)=O
|
|
MCULE-2662745028 |
0.60 |
C[C@@]12[C@H]3C(C=C4[C@@H]5C[C@@]6(C)C(=O)O[C@@H]([C@]5(C)CC[C@@]4(C)[C@]3(C)CC[C@H]1C(C)(C)[C@@H](O)CC2)C6)=O
|
|
MCULE-8110589241 |
0.60 |
C12CC1C1C=CC2C(C1C(=O)OC(C)C)C(O)=O
|
|
MCULE-2660227283 |
0.60 |
C12(C)CC=C3C(CCC4([H])CC(=O)CCC34C)C1CC(C)C2(O)C(=O)COC(C)=O
|
|
MCULE-1889700737 |
0.60 |
[Na+].CC12CCC3([H])C(C(OC(=O)CCC([O-])=O)CCC3(C)C1([H])C(C=C1C3([H])CC(C)(C(O)=O)CCC3(C)CCC21C)=O)(C)C
|
|
MCULE-9715251524 |
0.60 |
C1(CC2CCC1(OC)C=C2)C(OC)=O
|
|
MCULE-4992964291 |
0.60 |
C1C2C3CC(CC(=O)C)C3C(C3([H])C(=O)OC(=O)C32[H])C=1
|
|
MCULE-8615958761 |
0.60 |
C1C[C@]2(C)C3C(=O)C[C@]4(C)[C@@H]([C@@H](CCC(=O)OC)C)C[C@H](O)[C@@]4(C)C=3[C@@H](O)C[C@@]2([H])[C@@](C)(CO)C1=O
|
|
MCULE-8726234628 |
0.60 |
C12C3C(C)(CCC(C)(C(OCC#C)=O)C3)CCC1(C)C1(C(C(=O)C=2)C2(C)CCC(C(C)(C)C2CC1)OC(C)=O)C
|
|
MCULE-5549232456 |
0.60 |
[C@]12(C)CC=C3[C@@]([H])(CC[C@@]4([H])CC(=O)CC[C@]34C)C1C[C@@H](C)[C@]2(O)C(=O)COC(C)=O
|
|
MCULE-5281461360 |
0.60 |
C1(=O)C=CCCCC1
|
|
MCULE-5952812721 |
0.60 |
C1C[C@]2(C)[C@@]3([H])CC[C@]4(C)[C@@]([H])([C@@H](CC[C@@H](CC)C(C)C)C)[C@@H](O)C[C@@]4([H])[C@]3([H])[C@H](O)C=C2C[C@H]1O
|
|
MCULE-1027304648 |
0.60 |
O=C(/C=C1\CCCCC\1)CC1CC=CC1
|
|
MCULE-4195941884 |
0.60 |
CC(C1(C(C2CCCCC=2)=O)CC1)C
|
|
MCULE-5753734207 |
0.60 |
C1CC2C(CCC3OC(=O)CC(O)C3)C(C)C=CC2CC1
|
|
MCULE-2525177975 |
0.60 |
C1=CC2C3C4C(C(CO)C13)C=CC4C2CO
|
|
MCULE-2306367523 |
0.60 |
C12CC(CC1OC(CC)=O)C1C=CCC21
|
|
MCULE-6530848078 |
0.60 |
C1C[C@@]2(C)C(CCC(=C)[C@@H]2CC/C(=C/C(OC)=O)/C)[C@](C(O)=O)(C)C1
|
|
MCULE-8739489327 |
0.60 |
C12C(C(=O)C1)CC=C2
|
|
MCULE-3774604452 |
0.60 |
C1C[C@]2(C)[C@@]3([H])CC[C@]4(C)[C@@]([H])([C@@H](CCC(=C)C(C)C)C)[C@@H](O)C[C@@]4([H])[C@]3([H])[C@H](O)C=C2C[C@H]1O
|
|
MCULE-1938313770 |
0.60 |
O=C1C2C3CC(C4C3O4)C2C(C2C3CC(C=C3)C21)=O
|
|
MCULE-9090867563 |
0.60 |
[C@@]12(C(C)=O)CC3C(C)(CCC4C3CC=C3C4(C)CCC(O)C3)[C@@H]1O2
|
|
MCULE-5372838459 |
0.60 |
C(=O)(/C=C(\C)/C)CC(O)C(C)C
|
|
MCULE-3900892809 |
0.60 |
C(/C)(\C)=C/CC[C@H](C)CCO
|
|
MCULE-9408264926 |
0.60 |
OC([C@H]1[C@H](C(F)(F)F)CC=CC1)=O
|
|
MCULE-7243244779 |
0.60 |
C1(C)(C)C(=C)CCC1C(OC)=O
|
|
MCULE-7494382495 |
0.60 |
C1(C(C)C=CCC1(C)C)C(=O)C=CC
|
|
MCULE-5563387154 |
0.60 |
C1=CC2C(=O)C(=O)C1(C(C)(C)C)C1C=CC12
|
|
MCULE-9149239842 |
0.60 |
C1C[C@]2(C)[C@@]3([H])CC=C4[C@]5([H])[C@@H](C)[C@H](C)CC[C@]5(C)CC[C@@]4(C)[C@]3(C)CC[C@@]2([H])[C@@](C)(C(=O)O)[C@@H]1OC(=O)C
|
|
MCULE-7561172842 |
0.60 |
C1=CC2C3C4C(C(C(=O)C)C13)C=CC4C2C(=O)C
|
|
MCULE-5192933185 |
0.60 |
C([H])(CCCC)=C([H])CCCCO
|
|
MCULE-6493316496 |
0.60 |
O=C(CCC/C=C1/C[C@@]2([H])[C@@](C[C@H]([C@@H]2C#C[C@H](CCCCC)O)O)([H])C/1)O
|
|
MCULE-9248646594 |
0.60 |
C(C1N=N1)(C1CCC2C1(C)CCC1C2CC=C2CC(O)CCC21C)=O
|
|
MCULE-2507451013 |
0.60 |
[C@@]12(C)CC[C@@]3([H])[C@@](C)(C(=O)O)[C@@H](CC[C@]3(C)[C@@]1([H])CC=C1[C@]3([H])CC(CC[C@@]3(CC[C@@]21C)C)(C)C)OC(=O)C
|
|
MCULE-4204888723 |
0.60 |
C(/C)(\C)=C/CCC(C)CCO
|
|
MCULE-4187355503 |
0.60 |
CC1CC(C(C2CCCCCCC=2)=O)C1
|
|
MCULE-2778170549 |
0.60 |
O[C@]1(CC=C(C)CC1)C(C)C
|
|
MCULE-5850991547 |
0.60 |
C(/C)(\C)=C/CCC(C)C(C)O
|
|
MCULE-4738347913 |
0.60 |
C1(C(C)(C)C)=CC2(C(C)(C)C)C(=O)C(=O)C1C1C=CC12
|
|
MCULE-5466118884 |
0.60 |
C1C(CCCCC=1C)=O
|
|
MCULE-9144922088 |
0.60 |
C(C)(C12C(C)(CC3C4CC=C5CC(O)CCC5(C)C4CCC31C)O2)=O
|
|
MCULE-2969710957 |
0.60 |
C1CC2(C)C3CC=C4C5CC(C)(C)CCC5(C)CCC4(C)C3(C)CCC2C(C)(C(=O)O)C1OC(=O)C
|
|
MCULE-9704056914 |
0.60 |
O=C(C1CCCCCCC=1)C1C2(CC2)C1
|
|
MCULE-2258281526 |
0.60 |
C12(C)CCC3C(CC=C4CC(O)CCC34C)C1CCC12CO1
|
|
MCULE-2115945080 |
0.60 |
C12(C)CCC(CC1=CCC1C2CCC2(C1CCC2N)C)O
|
|
MCULE-7639346141 |
0.60 |
C1C[C@]2(C)C3CC[C@]4(C)[C@]5(O[C@H](C(=O)CC)C[C@H]5C)CC[C@@]4(C)C=3CC[C@@]2([H])[C@@](C)(CO)[C@H]1O
|
|
MCULE-1953446416 |
0.60 |
C12=CC(CC[C@]1(C)[C@@]1([H])CC[C@]3(C)C(CC[C@@]3([H])[C@]1([H])CC2=C)=O)=O
|
|
MCULE-5482566460 |
0.60 |
C1CC2(C)C3CC=C4C5C(C)C(C)CCC5(C)CCC4(C)C3(C)CCC2C(C)(C(=O)O)C1OC(=O)C
|
|
MCULE-5173677772 |
0.60 |
[C@@H]12C[C@@H](CC1OC(CC)=O)[C@]1([H])C=CC[C@]21[H]
|
|
MCULE-6797719021 |
0.60 |
C1C(=O)CC=C(C(C)C)C1
|
|
MCULE-4904314440 |
0.60 |
[Na+].C12(C)C(CCC1(C)C(=O)[O-])C(=C2)Br
|
|
MCULE-9005119173 |
0.60 |
C1CC23C([H])(COC(=O)C)C2(CC=CC3)CC1
|
|
MCULE-6511194668 |
0.60 |
C1(O)(C(C)C)CCC(=CC1)C
|
|
MCULE-7405954364 |
0.60 |
[C@@]12(C(C)=O)O[C@]1(C)CC1C3C(CC[C@]21C)[C@@]1(C)CCC(CC1=CC3)O
|
|
MCULE-8414068028 |
0.60 |
C1(CCCCCC=1)C=O
|
|