| MCULE-2355974075 |
0.96 |
C(C)(=O)OC1CCC2(C)C3CCC4(C)C(=CCO)CCC4C3CC=C2C1
|
|
| MCULE-4749657700 |
0.91 |
C12CC=C3CC(CCC3(C)C1CCC1(C)C(CCC21)(O)C=C)OC(=O)C
|
|
| MolPort-046-793-021 |
0.90 |
CC(=O)O[C@H]1CC[C@]2(C)[C@@H]3CC[C@@]4(C)[C@@H](CCC4=O)C3[C@@H](O)C=C2C1
|
|
| MolPort-002-841-870 |
0.89 |
CC(=O)OC1CCC2C3CC=C4C[C@](C)(CC[C@]4(C)C3CC[C@]12C)OC(C)=O
|
|
| MolPort-044-755-192 |
0.89 |
CC(=O)O[C@H]1CC[C@]2(C)[C@H]3CC[C@]4(C)CCC[C@H]4[C@@H]3CC=C2C1
|
|
| MolPort-002-525-850 |
0.89 |
CC[C@H](\C=C\[C@@H](C)[C@H]1CCC2[C@@H]3CC=C4C[C@H](CC[C@]4(C)C3CC[C@]12C)OC(C)=O)C(C)C
|
|
| MolPort-002-911-161 |
0.89 |
CC(=O)OC1CCC2C3CC=C4CC(CCC4(C)C3CCC12C)OC(C)=O
|
|
| MolPort-006-069-320 |
0.89 |
CC(=O)O[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-002-530-229 |
0.89 |
CC(=O)O[C@H]1CC[C@H]2[C@@H]3CC=C4CC(CC[C@]4(C)[C@H]3CC[C@]12C)OC(C)=O
|
|
| MolPort-003-855-523 |
0.89 |
CCCCCCCCC1CCC2C3CC=C4CC(CCC4(C)C3CCC12C)OC(C)=O
|
|
| MolPort-002-525-741 |
0.89 |
CC(=O)O[C@H]1CC[C@]2(C)C3CC[C@]4(C)[C@@H](O)CCC4[C@@H]3CC=C2C1
|
|
| MolPort-002-506-890 |
0.89 |
CC(=O)O[C@H]1CC[C@]2(C)[C@H]3CC[C@]4(C)[C@@H](O)CC[C@H]4[C@@H]3CC=C2C1
|
|
| MolPort-002-509-518 |
0.89 |
CC[C@H](CC[C@@H](C)[C@H]1CCC2[C@@H]3CC=C4C[C@H](CC[C@]4(C)C3CC[C@]12C)OC(C)=O)C(C)C
|
|
| MolPort-000-722-953 |
0.89 |
CC(=O)OC1CCC2(C)C3CCC4(C)C(O)CCC4C3CC=C2C1
|
|
| MolPort-002-520-667 |
0.89 |
CC(C)CCC[C@@H](C)[C@H]1CCC2[C@@H]3CC=C4C[C@H](CC[C@]4(C)C3CC[C@]12C)OC(C)=O
|
|
| MolPort-003-891-594 |
0.89 |
CCC(CCC(C)C1CCC2C3CC=C4CC(CCC4(C)C3CCC12C)OC(C)=O)C(C)C
|
|
| MolPort-000-830-370 |
0.89 |
CC(=O)OC1CCC2C3CC=C4CC(CC[C@]4(C)C3CC[C@]12C)OC(C)=O
|
|
| MolPort-000-827-350 |
0.89 |
CC(C)CCCC(C)C1CCC2C3CC=C4CC(CC[C@]4(C)C3CC[C@]12C)OC(C)=O
|
|
| MolPort-003-803-623 |
0.89 |
CC(=O)O[C@H]1CC[C@]2(C)C3CC[C@]4(C)CCCC4C3CC=C2C1
|
|
| MolPort-002-501-633 |
0.89 |
CC(C)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-002-889-412 |
0.89 |
CC(C)CCCC(C)C1CCC2C3CC=C4C[C@H](CC[C@]4(C)C3CC[C@]12C)OC(C)=O
|
|
| MolPort-046-766-245 |
0.89 |
CC(CO)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-023-314-383 |
0.89 |
CC(C)[C@H]1CC[C@@H]2[C@]1(C)CC[C@]1(C)[C@H]3CC=C4[C@@H](CC[C@H](OC(C)=O)C4(C)C)[C@]3(C)CC[C@@]21C
|
|
| MolPort-000-295-003 |
0.89 |
CC(C)CCCC(C)C1CCC2C3CC=C4CC(CCC4(C)C3CCC12C)OC(C)=O
|
|
| MolPort-006-116-362 |
0.89 |
CC[C@H](\C=C\[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)C(C)C
|
|
| MolPort-002-527-905 |
0.89 |
CCCCCCCC[C@H]1CC[C@H]2[C@@H]3CC=C4C[C@H](CC[C@]4(C)[C@H]3CC[C@]12C)OC(C)=O
|
|
| MCULE-3027567956 |
0.89 |
[C@]12(C)CCC(CC1=CCC1C2CC[C@]2(C1CCC2OC(C)=O)C)OC(C)=O
|
|
| MCULE-2754730792 |
0.89 |
C12(C)CCC(CC1=CCC1C2CCC2(C1CCC2O)C)OC(C)=O
|
|
| MCULE-4320332467 |
0.89 |
C(C)(=O)OC1CCC2(C)C3CCC4(C)C(C(C)CCC(C)C(C)C)CCC4C3CC=C2C1
|
|
| MCULE-2328694476 |
0.89 |
[C@@]12([H])CC=C3C[C@@H](OC(=O)C)CC[C@]3(C)[C@@]1([H])CC[C@]1(C)[C@H](CC[C@@]21[H])[C@H](C)CC[C@@H](CC)C(C)C
|
|
| MCULE-5953628396 |
0.89 |
C12(C)CCC(CC1=CCC1C2CCC2(C1CCC2CCCCCCCC)C)OC(C)=O
|
|
| MCULE-7999402217 |
0.89 |
[C@]12(C)CC[C@](CC1=CCC1C2CC[C@]2(C1CCC2OC(C)=O)C)(C)OC(C)=O
|
|
| MCULE-3331989617 |
0.89 |
C(C)(=O)OC1CCC2(C)C(C1)(CC=C1C3CCC(C(C)C=CC(C)C(C)C)C3(C)CC(C21)OC(C)=O)[H]
|
|
| MCULE-4346215084 |
0.89 |
[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(C)=O
|
|
| MCULE-2048707819 |
0.89 |
[C@]12(C)CCC3[C@@]([H])(CC=C4C[C@H](CC[C@]34C)OC(C)=O)C1CC[C@]2([H])[C@H](C)CC[C@@H](CC)C(C)C
|
|
| MCULE-2069877830 |
0.89 |
C(C)(=O)OC1CCC2(C)C(C1(C)C)=CCC1C2CCC2(C)C(C(C)CCCC(C)C)CCC21
|
|
| MCULE-6330480709 |
0.89 |
C(C)(=O)OC1CCC2(C)C3CCC4(C)CCCC4C3CC=C2C1
|
|
| MCULE-7413623623 |
0.89 |
C12(C)CCC3C(CC=C4CC(CCC34C)OC(C)=O)C1CCC2C(C)CCCC(C)C
|
|
| MCULE-3254382141 |
0.89 |
C12(C)CCC(OC(C)=O)CC1=CCC1C2CCC2(C)C1CCC2=CC
|
|
| MCULE-3496812213 |
0.89 |
C12(C)CCC3C(CC=C4CC(CCC34C)OC(C)=O)C1CCC2C(C)CCC(CC)C(C)C
|
|
| MCULE-7757466005 |
0.89 |
[C@]12(C)CCC3[C@@]([H])(CC=C4C[C@H](CC[C@]34C)OC(C)=O)C1CC[C@@H]2[C@H](C)C=C[C@@H](CC)C(C)C
|
|
| MCULE-5473746623 |
0.89 |
[C@]12(C)CC[C@@H](CC1=CC[C@]1([H])[C@]2([H])CC[C@]2([C@@]1([H])CC[C@@H]2O)C)OC(C)=O
|
|
| MCULE-8641360664 |
0.89 |
C(C)(=O)OC1CCC2(C)C3CCC4(C)C(C(C)C(O)CCC(C)C)CCC4C3CC=C2C1
|
|
| MCULE-3117776619 |
0.89 |
C(C)(=O)OC1CCC2(C)C(C1)=CCC1C3CCC(C(C)C=CC(C)C(C)C)C3(C)CCC12[H]
|
|
| MCULE-2659782471 |
0.89 |
[C@]12(C)CC[C@]3([C@@]([H])(CC=C4C[C@H](CC[C@]34C)OC(C)=O)[C@]1([H])CC[C@@H]2[C@H](C)CCCC(C)C)[H]
|
|
| MCULE-7842753172 |
0.89 |
C12(C)CCC3C(CC=C4CC(CCC34C)OC(C)=O)C1CCC2C(C)O
|
|
| MCULE-1546940698 |
0.89 |
C12CCC3(C)C(CCC3C1CC=C1CC(CCC21C)OC(=O)C)OC(=O)C
|
|
| MolPort-046-153-744 |
0.88 |
CC(=O)O[C@H]1CC[C@@H]2C(=CC[C@H]3[C@@]2(C)CC[C@@]2(C)[C@@H]4CC(C)(C)CC[C@]4(C)CC[C@]32C)C1(C)C
|
|
| MolPort-002-513-643 |
0.88 |
CC(=O)OC1CCC2C(=CCC3[C@@]2(C)CC[C@@]2(C)C4CC(C)(C)CC[C@]4(C)CC[C@]32C)C1(C)C
|
|
| MolPort-023-331-412 |
0.87 |
CC(C)(C)C(=O)O[C@H]1CC[C@]2(C)[C@H]3CC[C@@]4(C)[C@@H]([C@@H]5C[C@@H]5C4=O)[C@@H]3[C@@H](O)C=C2C1
|
|
| MolPort-000-295-000 |
0.86 |
CCC(=O)OC1CCC2(C)C3CCC4(C)C(CCC4C3CC=C2C1)C(C)CCCC(C)C
|
|
| MolPort-002-510-720 |
0.86 |
CCC(=O)OC1CCC2C3CC=C4CC(CC[C@]4(C)C3CC[C@]12C)OC(=O)CC
|
|
| MolPort-003-987-065 |
0.86 |
CCC(=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-002-826-614 |
0.86 |
CC(C)CCCC(C)C1CC[C@@H]2C3CC=C4C[C@@H](CCC4(C)[C@@H]3CCC12C)OC(=O)C(C)C
|
|
| MolPort-003-855-481 |
0.86 |
CCCCCCCCC1CCC2C3CC=C4CC(CCC4(C)C3CCC12C)OC(=O)CC
|
|
| MolPort-002-510-337 |
0.86 |
CCCCCCCCC1CCC2C3CC=C4C[C@H](CC[C@]4(C)C3CC[C@]12C)OC(=O)CC
|
|
| MCULE-3755877935 |
0.86 |
C12(C)CCC3C(CC=C4CC(CCC34C)OC(CC)=O)C1CCC2C(C)CCCC(C)C
|
|
| MCULE-4480469003 |
0.86 |
[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)CC)CC1=CC2)[H]
|
|
| MCULE-8277570953 |
0.86 |
C12(C)CCC(CC1=CCC1C2CCC2(C1CCC2CCCCCCCC)C)OC(CC)=O
|
|
| MCULE-2241145060 |
0.86 |
[C@]12(C)CC[C@@H](CC1=CCC1C2CC[C@]2(C1CCC2CCCCCCCC)C)OC(CC)=O
|
|
| MCULE-1853650577 |
0.86 |
C12(C)CC[C@@]3(C(CC=C4C[C@@]([H])(CCC34C)OC(C(C)C)=O)[C@@]1([H])CCC2C(C)CCCC(C)C)[H]
|
|
| MCULE-8698149631 |
0.86 |
[C@]12(C)CCC(CC1=CCC1C2CC[C@]2(C1CCC2OC(CC)=O)C)OC(CC)=O
|
|
| MCULE-9703213540 |
0.86 |
C(C)(=O)OC1CCC2(C)C3CCC4(C)C=CCC4C3CC=C2C1
|
|
| MCULE-7170821286 |
0.86 |
C(C)(=O)OC1CCC2(C)C3CCC4(C)C(=CCOC(C)=O)CCC4C3CC=C2C1
|
|
| MCULE-7796031571 |
0.86 |
C1(CCCCC1C1CCCCC=1)OC(C)=O
|
|
| MolPort-001-921-995 |
0.86 |
CC(=O)OC1CCCCC1C1=CCCCC1
|
|
| MCULE-2808257085 |
0.85 |
C(C)(=O)OC1CCC2(COC(C)=O)C3CCC4(C)C(CCC4C3CC=C2C1)C(OCC)=O
|
|
| MCULE-4823161367 |
0.85 |
[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(CCC)=O
|
|
| MCULE-9280847330 |
0.85 |
[C@@]12([H])CC=C3C[C@@H](OC(=O)CCC)CC[C@]3(C)[C@@]1([H])CC[C@]1(C)[C@H](CC[C@@]21[H])[C@H](C)CCCC(C)C
|
|
| MCULE-3393292584 |
0.85 |
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])CC=C2C[C@H]1OC(=O)C
|
|
| MCULE-6762964573 |
0.85 |
C(CC(C)C)(=O)OC1CCC2(C)C3CCC4(C)C(C(C)CCCC(C)C)CCC4C3CC=C2C1
|
|
| MCULE-9929087674 |
0.85 |
C12(C)CCC(CC1=CCC1C2CCC2(C1CCC2CCCCCCCC)C)OC(CCC)=O
|
|
| MCULE-2391054675 |
0.85 |
C12(C)CCC3C(CC=C4CC(CCC34C)OC(CCC)=O)C1CCC2C(C)CCCC(C)C
|
|
| MolPort-003-892-826 |
0.85 |
CCCC(=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-003-855-482 |
0.85 |
CCCCCCCCC1CCC2C3CC=C4CC(CCC4(C)C3CCC12C)OC(=O)CCC
|
|
| MolPort-039-052-421 |
0.85 |
CC[C@@H](\C=C\[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)C(C)=C
|
|
| MolPort-001-928-668 |
0.85 |
CCCC(=O)OC1CCC2(C)C3CCC4(C)C(CCC4C3CC=C2C1)C(C)CCCC(C)C
|
|
| MolPort-002-528-225 |
0.85 |
CCCCCCCC[C@H]1CC[C@H]2[C@@H]3CC=C4C[C@H](CC[C@]4(C)[C@H]3CC[C@]12C)OC(=O)CCC
|
|
| MCULE-4665107833 |
0.84 |
C(C)(=O)OC1CCC2(C)C(O)(C1)CCC1(O)C3CCC(C(C)CCC(C)C(C)C)C3(C)CC=C21
|
|
| MolPort-044-755-199 |
0.84 |
CC(=O)O[C@H]1CC[C@H]2[C@@H]3CCC4=C[C@@H](O)CC[C@]4(C)[C@H]3CC[C@]12C
|
|
| MolPort-046-688-689 |
0.84 |
CC(=O)O[C@H]1CC[C@H]2[C@@H]3CC[C@H]4CC=C[C@H](O)[C@]4(C)[C@H]3CC[C@]12C
|
|
| MolPort-042-646-617 |
0.83 |
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 |
0.83 |
CC[C@@H]1CC2C3CC=C4CC(CC[C@]4(C)C3CC[C@]2(C)[C@H]1C(C)=O)OC(C)=O
|
|
| MolPort-002-730-176 |
0.83 |
CC(CCCC(C)=O)C1CCC2C3CC=C4CC(CC[C@]4(C)C3CC[C@]12C)OC(C)=O
|
|
| MolPort-046-596-384 |
0.83 |
CC(CCC(O)=O)C1CCC2C3CC=C4CC(CC[C@]4(C)C3CC[C@]12C)OC(C)=O
|
|
| MolPort-002-510-678 |
0.83 |
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-003-855-529 |
0.83 |
CCCCCCCCC1CCC2C3CC=C4CC(CCC4(C)C3CCC12C)OC(=O)CCCC
|
|
| MolPort-000-835-607 |
0.83 |
CC(=O)OC1CC[C@]2(C)C3CC[C@@]4(C)C(CCC4C(O)=O)C3CC=C2C1
|
|
| MolPort-002-158-100 |
0.83 |
CC(=O)OC1CCC2(C)C3CCC4(C)C(CC5CCCCC45C(C)=O)C3CC=C2C1
|
|
| MolPort-000-838-146 |
0.83 |
CC(=O)OC1CC[C@]2(C)C3CC[C@@]4(C)C(CCC4=O)C3CC=C2C1
|
|
| MolPort-001-535-946 |
0.83 |
CC(=O)OC1CCC2(C)C3CCC4(C)C(CCC4C(C)=O)C3CC=C2C1
|
|
| MolPort-002-510-721 |
0.83 |
CCCCCCCCC1CCC2C3CC=C4C[C@H](CC[C@]4(C)C3CC[C@]12C)OC(=O)CCCC
|
|
| MolPort-002-686-234 |
0.83 |
C[C@@H]1CC2C3CC=C4CCCC(OC(C)=O)C4(C)C3CCC2(C)[C@@]1(C)C(C)=O
|
|
| MolPort-002-524-141 |
0.83 |
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 |
0.83 |
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-023-221-501 |
0.83 |
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-002-529-366 |
0.83 |
CCCCCCCC[C@H]1CC[C@H]2[C@@H]3CC=C4C[C@H](CC[C@]4(C)[C@H]3CC[C@]12C)OC(=O)CC(C)CC
|
|
| MolPort-046-596-311 |
0.83 |
CC(=O)O[C@@H]1CC[C@]2(C)C3CC[C@@]4(C)C(CC5CCCCC45C(C)=O)C3CC=C2C1
|
|
| MolPort-002-507-454 |
0.83 |
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-002-528-770 |
0.83 |
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-002-515-746 |
0.83 |
CC[C@@H]1CC2C3CC=C4CC(CC[C@]4(C)C3CC[C@]2(C)[C@H]1C(=O)CC)OC(C)=O
|
|
| MolPort-002-506-956 |
0.83 |
CC(=O)O[C@H]1CC[C@]2(C)[C@H]3CC[C@@]4(C)[C@@H](CCC4=O)[C@@H]3CC=C2C1
|
|
| MolPort-002-506-933 |
0.83 |
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-046-763-326 |
0.83 |
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-002-798-252 |
0.83 |
CC(=O)O[C@H]1CC[C@]2(C)C3CC[C@@]4(C)C(CCC4=O)C3CC=C2C1
|
|
| MolPort-003-855-522 |
0.83 |
CCCCCCCCC1CCC2C3CC=C4CC(CCC4(C)C3CCC12C)OC(=O)CC(C)CC
|
|
| MolPort-002-501-678 |
0.83 |
CCCCC(=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-000-691-651 |
0.83 |
CC(=O)OC1CCC2(C)C3CCC4(C)C(CCC4=O)C3CC=C2C1
|
|
| MolPort-000-738-028 |
0.83 |
C[C@@H]1CC2C3CC=C4CC(CCC4(C)C3CCC2(C)[C@@]1(C)C(C)=O)OC(C)=O
|
|
| MolPort-002-527-697 |
0.83 |
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-000-744-261 |
0.83 |
CC(CCC(O)=O)C1CCC2C3CC=C4CC(CCC4(C)C3CCC12C)OC(C)=O
|
|
| MolPort-002-810-909 |
0.83 |
CC1CC2C3CC=C4CC(CCC4(C)C3CCC2(C)C1(C)C(C)=O)OC(C)=O
|
|
| MolPort-002-810-910 |
0.83 |
CCC1CC2C3CC=C4CC(CCC4(C)C3CCC2(C)C1C(C)=O)OC(C)=O
|
|
| MolPort-002-524-244 |
0.83 |
CC(=O)O[C@@H]1CC[C@]2(C)C3CC[C@@]4(C)C(CC5CCCC[C@@]45C(C)=O)[C@@H]3CC=C2C1
|
|
| MolPort-001-785-924 |
0.83 |
CC(=O)OC1CCC2(C)C3CCC4(C)C(CCC4C(O)=O)C3CC=C2C1
|
|
| MolPort-046-597-310 |
0.83 |
CC[C@@H]1CC2C3CC=C4CC(CC[C@]4(C)C3CC[C@]2(C)C1C(C)=O)OC(C)=O
|
|
| MolPort-044-755-262 |
0.83 |
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
|
|
| MCULE-9076166215 |
0.83 |
[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-9533823250 |
0.83 |
[C@]12(C)CCC3C(CC=C4CC(CC[C@]34C)OC(C)=O)C1CCC2C(C)CCCC(C)=O
|
|
| MCULE-6118345848 |
0.83 |
C(C)(=O)OC1CCC2(C)C3CCC4(C)C(C(C)C(CCC(C)C)=O)CCC4C3CC=C2C1
|
|
| MCULE-9728792876 |
0.83 |
C12(C)C(=O)C(C)CC1C1C(CC2)C2(C)CCC(CC2=CC1)OC(C)=O
|
|
| MCULE-5701442831 |
0.83 |
C12(C)CCC(CC1=CCC1C2CCC2(C1CCC2=O)C)OC(C)=O
|
|
| MCULE-7088876584 |
0.83 |
C12(C)CCC3C(CC=C4CC(CCC34C)OC(C)=O)C1CCC2C(C)CCCC(C)=O
|
|
| MCULE-3880817234 |
0.83 |
C(C)(=O)OC1CCC2(C)C3CCC4(C)C(C(C)CCC(CC)=O)CCC4C3CC=C2C1
|
|
| MCULE-2803933654 |
0.83 |
C12(C)CCC3C(CC=C4CCCC(OC(C)=O)C34C)C1C[C@@H](C)[C@]2(C)C(C)=O
|
|
| MCULE-8712822346 |
0.83 |
[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-7993538244 |
0.83 |
[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-4605464077 |
0.83 |
[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-8183627372 |
0.83 |
C12(C)CCC3C(CC=C4CC(CCC34C)OC(C)=O)C1CC1CCCCC21C(C)=O
|
|
| MCULE-3093682807 |
0.83 |
C12(C)CCC3C(CC=C4CC(CCC34C)OC(C)=O)C1CC(C)C2(C)C(C)=O
|
|
| MCULE-4910370058 |
0.83 |
C12(C)CCC3C(CC=C4CC(CCC34C)OC(C)=O)C1CCC2C(C)=O
|
|
| MCULE-4121090747 |
0.83 |
C12(C)CCC3C(CC=C4CC(CCC34C)OC(C)=O)C1CC(CC)C2C(C)=O
|
|
| MCULE-9886067523 |
0.83 |
[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-4068140047 |
0.83 |
C(C)(=O)OC1CC2C(C)(C3CCC4(C)C(C(C)C(O)=O)CCC4C3CC=2)CC1
|
|
| MCULE-7379708485 |
0.83 |
C12(C)CCC3C(CC=C4CC(CCC34C)OC(C)=O)C1CCC2C(O)=O
|
|
| MCULE-1105300545 |
0.83 |
[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(CC(C)CC)=O
|
|
| MCULE-2274449987 |
0.83 |
C12(C)CCC3C(CC=C4CCCC(OC(C)=O)C34C)C1CC(C)C2(C)C(C)=O
|
|
| MCULE-6563972685 |
0.83 |
C12(C)CCC(CC1=CCC1C2CCC2(C1CCC2CCCCCCCC)C)OC(CCCC)=O
|
|
| MCULE-5145383615 |
0.83 |
[C@]12(C)CC[C@@H](CC1=CCC1C2CC[C@]2(C1CCC2CCCCCCCC)C)OC(CCCC)=O
|
|
| MCULE-9028214804 |
0.83 |
[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-2565904577 |
0.83 |
C(CCCC)(=O)OC1CCC2(C)C3CCC4(C)C(C(C)CCCC(C)C)CCC4C3CC=C2C1
|
|
| MCULE-5237548292 |
0.83 |
C(C)(=O)OC1CCC2(C)C3CCC4(C)C(=CC=C)CCC4C3CC=C2C1
|
|
| MCULE-9491535728 |
0.83 |
C12(C)CCC3C(CC=C4CC(CCC34C)OC(C)=O)C1CCC2C(C)CCC(O)=O
|
|
| MCULE-6215028771 |
0.83 |
[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)CCCC)CC1=CC2)[H]
|
|
| MCULE-1074800625 |
0.83 |
[C@]12(C)CCC3C(CC=C4CC(CC[C@]34C)OC(C)=O)C1C[C@@H](CC)[C@@H]2C(CC)=O
|
|
| MCULE-6652384834 |
0.83 |
C12(C)CCC(CC1=CCC1C2CCC2(C1CCC2CCCCCCCC)C)OC(CC(C)CC)=O
|
|
| MCULE-4498603332 |
0.83 |
C(C)(=O)OC1CCC2(C)C3CCC4(C)C(=CCC4C3CC=C2C1)C(C)(OC(C)=O)[H]
|
|
| MCULE-1550349961 |
0.83 |
C12(C)CCC3C(CC=C4CC(CCC34C)OC(C)=O)C1CC=C2C(O)CCOC(C)=O
|
|
| MCULE-3699550787 |
0.83 |
C12=CCCCC1([H])C(CCCCOC(C)=O)OC1CCCC[C@@]21[H]
|
|
| MCULE-9024401259 |
0.83 |
C12(C)CCC(CC1=CCC1C2CCC2(C1CCC2CCCCCCCC)C)OC(=O)C=CC
|
|
| MCULE-4343790137 |
0.83 |
C12(C)CCC3C(CC=C4CC(CCC34C)OC(=O)C([H])=C([H])C)C1CCC2C(C)CCCC(C)C
|
|
| MCULE-8493622164 |
0.83 |
[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(=O)C=CC
|
|
| MolPort-002-511-686 |
0.83 |
CC(=O)OCCCCC1OC2CCCC[C@H]2C2=CCCCC12
|
|
| MolPort-003-702-338 |
0.83 |
C\C=C\C(=O)OC1CCC2(C)C3CCC4(C)C(CCC4C3CC=C2C1)C(C)CCCC(C)C
|
|
| MolPort-002-530-454 |
0.83 |
CCCCCCCC[C@H]1CC[C@H]2[C@@H]3CC=C4C[C@H](CC[C@]4(C)[C@H]3CC[C@]12C)OC(=O)\C=C\C
|
|
| MolPort-003-855-527 |
0.83 |
CCCCCCCCC1CCC2C3CC=C4CC(CCC4(C)C3CCC12C)OC(=O)\C=C\C
|
|
| MolPort-002-568-054 |
0.82 |
CC(=O)OCCC1=CCC2CC1C2(C)C
|
|
| MolPort-046-762-563 |
0.82 |
CC(=O)OC1(C)CC[C@@H]2[C@@H]3CC=C4C[C@@H](O)CC[C@@H]4[C@@H]3CC[C@]12C
|
|
| MolPort-046-762-523 |
0.82 |
CC(=O)O[C@@]1(C)CC[C@H]2[C@@H]3CC=C4C[C@@H](O)CC[C@@H]4[C@H]3CC[C@]12C
|
|
| MCULE-1991391695 |
0.82 |
C12C(CCOC(C)=O)=CCC(C1(C)C)C2
|
|
| MCULE-1255015250 |
0.82 |
C12(C)CCC3(C([H])(CC=C4CC(CCC34C)OC(C)=O)C1([H])CC(=C)C2(O)C(C)=O)[H]
|
|
| MCULE-3687395332 |
0.82 |
C12(C)CCC3C(CC=C4CC(CCC34C)OC(CCCC(=O)OC3CCC4(C(=CCC5C4CCC4(C5CCC4C(C)CCCC(C)C)C)C3)C)=O)C1CCC2C(C)CCCC(C)C
|
|
| MCULE-7665525246 |
0.82 |
C(C)(=O)OC1CCC2(C)C(C1)(CC=C1C3CCC(C(C)C=CC(C)C(C)C)C3(C)CC(O)C21)[H]
|
|
| MCULE-2887956476 |
0.82 |
C12(C)CCC3C(CC=C4CC(CCC34C)OC(C)=O)C1CCC2(O)C(C)=O
|
|
| MCULE-3362097880 |
0.82 |
[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-5268900721 |
0.82 |
[C@]12(C)CC[C@@H](CC1=CCC1C2CC[C@]2(C1CCC2CCCCCCCC)C)OC(CCCCCCC)=O
|
|
| MCULE-4759733755 |
0.82 |
[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 |
0.82 |
[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-1675088199 |
0.82 |
C12(C)CCC3C(CC=C4CC(CCC34C)OC(CCCCCCC)=O)C1CCC2C(C)CCCC(C)C
|
|
| MCULE-3568637165 |
0.82 |
C12(C)CCC3C(CC=C4CC(CCC34C)OC(CCCCCCCCC)=O)C1CCC2C(C)CCCC(C)C
|
|
| MCULE-1588785943 |
0.82 |
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-8977795489 |
0.82 |
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-5520472136 |
0.82 |
C12(C)CCC3C(CC=C4CC(CCC34C)OC(C)=O)C1CC(C)C2(O)C(C)=O
|
|
| MCULE-7572819806 |
0.82 |
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-6785867509 |
0.82 |
[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-1286036245 |
0.82 |
[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-1091492885 |
0.82 |
[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-4487426289 |
0.82 |
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-2730494737 |
0.82 |
C12(CCC3(C4(CCC(CC4=CCC3(C1(CCC2([H])C(C)CCCC(C)C)[H])[H])OC(=O)CCCCCCCCCCCCCCC)C)[H])C
|
|
| MCULE-3557825189 |
0.82 |
C12(C)CCC3C(CC=C4CC(CCC34C)OC(C3CCCC3)=O)C1CCC2C(C)CCCC(C)C
|
|
| MCULE-3263354032 |
0.82 |
C12(C)CCC3C(CC=C4CC(CCC34C)OC(CCCCCCCCCCCCC)=O)C1CCC2C(C)CCCC(C)C
|
|
| MCULE-3951215552 |
0.82 |
[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-1928835025 |
0.82 |
C12(C)CCC3C(CC=C4CC(CCC34C)OC(CCCCCCCCCC)=O)C1CCC2C(C)CCCC(C)C
|
|
| MCULE-3569475442 |
0.82 |
C12(C)CCC3C(CC=C4CC(CCC34C)OC(CCCCCCCC)=O)C1CCC2C(C)CCCC(C)C
|
|
| MCULE-8461996452 |
0.82 |
C12(C)CCC3C(CC=C4CC(CCC34C)OC(CCCCCC)=O)C1CCC2C(C)CCCC(C)C
|
|
| MCULE-9543309945 |
0.82 |
C12(C)CCC3C4(C)CCC(OC(=O)C)CC4=CCC3C1CCC2C(=O)OC1CC2CCC1C2
|
|
| MCULE-4894890520 |
0.82 |
C12(C)CCC3(C4(C)CCC(OC(CCCCCCCCCCCC=CCCCCCCCC)=O)CC4=CCC3([H])C1(CCC2C(C)CCCC(C)C)[H])[H]
|
|
| MCULE-7973895970 |
0.82 |
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-9987906336 |
0.82 |
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-5476020058 |
0.82 |
C12(CCC3(C4(CCC(OC(CCCCCCCCCCC)=O)CC4=CCC3(C1(CCC2C(C)CCCC(C)C)[H])[H])C)[H])C
|
|
| MCULE-4016604549 |
0.82 |
C12(C)CCC(CC1=CCC1C2CCC2(C1CCC2=O)C)OC(CCCCCC)=O
|
|
| MCULE-2831209997 |
0.82 |
[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-3582226231 |
0.82 |
[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-7271710617 |
0.82 |
[C@]12(C)CC[C@@H](CC1=CCC1C2CC[C@]2(C1CCC2CCCCCCCC)C)OC(CCCCCCCCCC)=O
|
|
| MCULE-6581533408 |
0.82 |
C12(C)CCC(CC1=CCC1C2CCC2(C1CCC2CCCCCCCC)C)OC(CCCCCC)=O
|
|
| MCULE-8816644358 |
0.82 |
C12(C)CCC3C(CC=C4CC(CCC34C)OC(C)=O)C1CC[C@]2(O)C(C)=O
|
|
| MCULE-9783531925 |
0.82 |
C12(C)CCC(CC1=CCC1C2CCC2(C1CCC2CCCCCCCC)C)OC(CCCCCCC)=O
|
|
| MCULE-7300055150 |
0.82 |
[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-6943417160 |
0.82 |
C12(CC3CC(CC(C3)C1)C2)C(=O)OC1CCC2(C(=CCC3C2CCC2(C3CCC2CCCCCCCC)C)C1)C
|
|
| MCULE-7313126879 |
0.82 |
C12(C)CCC(CC1=CCC1C2CCC2(C1CCC2CCCCCCCC)C)OC(CC1CCCCC1)=O
|
|
| MCULE-1526124264 |
0.82 |
[C@]12(C)CC[C@@H](CC1=CCC1C2CC[C@]2(C1CCC2CCCCCCCC)C)OC(CC1CCCCC1)=O
|
|
| MCULE-1587965499 |
0.82 |
[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-8608886418 |
0.82 |
C12(C)CCC(CC1=CCC1C2CCC2(C1CCC2CCCCCCCC)C)OC(CCCCCCCC)=O
|
|
| MCULE-5265419450 |
0.82 |
C12(C)CCC(CC1=CCC1C2CCC2(C1CCC2CCCCCCCC)C)OC(CCCCCCCCCCCCC)=O
|
|
| MCULE-7551134886 |
0.82 |
[C@]12(C)CCC(CC1=CCC1C2CC[C@]2(C1CCC2=O)C)OC(CCCCCC)=O
|
|
| MCULE-1257490890 |
0.82 |
C12(C)CCC(CC1=CCC1C2CCC2(C1CCC2CCCCCCCC)C)OC(CCCCCCCCCCCC)=O
|
|
| MCULE-7000169771 |
0.82 |
[C@]12(C)CC[C@@H](CC1=CCC1C2CC[C@]2(C1CCC2CCCCCCCC)C)OC(CCCCCCCCC)=O
|
|
| MCULE-1900297968 |
0.82 |
C12(C)CCC(CC1=CCC1C2CCC2(C1CCC2CCCCCCCC)C)OC(CCCCCCCCCCC)=O
|
|
| MCULE-8572432727 |
0.82 |
[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-5451000624 |
0.82 |
C12(C)CCC(CC1=CCC1C2CCC2(C1CCC2CCCCCCCC)C)OC(CCCCCCCCCC)=O
|
|
| MCULE-6654749941 |
0.82 |
[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-4593875674 |
0.82 |
[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-6929994718 |
0.82 |
[C@]12(C)CC[C@@H](CC1=CCC1C2CC[C@]2(C1CCC2CCCCCCCC)C)OC(CCCCCCCCCCC)=O
|
|
| MCULE-8057071681 |
0.82 |
C12(C)CCC(CC1=CCC1C2CCC2(C1CCC2CCCCCCCC)C)OC(CCCCC)=O
|
|
| MCULE-7277178316 |
0.82 |
[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-7560687727 |
0.82 |
[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-9767686096 |
0.82 |
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-9956647861 |
0.82 |
C12(C)CCC(CC1=CCC1C2CCC2(C1CCC2CCCCCCCC)C)OC(C1CCCC1)=O
|
|
| MCULE-6594306024 |
0.82 |
C12(C)CCC3C(CC=C4CC(CCC34C)OC(CCC3CCCCC3)=O)C1CCC2C(C)CCCC(C)C
|
|
| MCULE-5475024726 |
0.82 |
[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-3632686303 |
0.82 |
[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-8252955604 |
0.82 |
[C@]12(C)CC[C@@H](CC1=CCC1C2CC[C@]2(C1CCC2CCCCCCCC)C)OC(CCCCCCCCCCCCC)=O
|
|
| MCULE-4311810496 |
0.82 |
[C@]12(C)CC[C@@H](CC1=CCC1C2CC[C@]2(C1CCC2CCCCCCCC)C)OC(CCCCCCCCCCCC)=O
|
|
| MCULE-4139907319 |
0.82 |
C12(C)CCC(CC1=CCC1C2CCC2(C1CCC2CCCCCCCC)C)OC(CCCCCCCCC)=O
|
|
| MCULE-9770266464 |
0.82 |
C12(C)CCC3C(CC=C4CC(CCC34C)OC(CCCCCCCC=CCCCCCCCC)=O)C1CCC2C(C)CCCC(C)C
|
|
| MCULE-7699673107 |
0.82 |
C1(OC(=O)CCCCCCCCCCCCCCCCC)CCC2(C)C3CCC4(C)C(C(CCCC(C)C)C)CCC4C3CC=C2C1
|
|
| MCULE-7520151391 |
0.82 |
C1CC2(C)C3CCC4(C)C(C(OC5CCCCC5)=O)CCC4C3CC=C2CC1OC(=O)C
|
|
| MCULE-9783163200 |
0.82 |
[Na+].C1CC2(C)C3CCC4(C)C(C([O-])=O)CCC4C3CC=C2CC1OC(=O)C
|
|
| MCULE-6883610361 |
0.82 |
[C@]12(C)CC[C@@H](CC1=CCC1C2CC[C@]2(C1CCC2CCCCCCCC)C)OC(CCCCCCCCCCCCCCC)=O
|
|
| MCULE-1361205448 |
0.82 |
C12(C)CCC(CC1=CCC1C2CCC2(C1CCC2CCCCCCCC)C)OC(CCC1CCCCC1)=O
|
|
| MCULE-6482288037 |
0.82 |
C1CC2(C)C3CCC4(C)C(C(CCCC(C)C)C)CCC4C3CC=C2CC1OC(=O)C=CCC(C)C
|
|
| MolPort-016-578-938 |
0.82 |
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-027-847-790 |
0.82 |
CCCCCCCCC1CCC2C3CC=C4C[C@H](CC[C@]4(C)C3CC[C@]12C)OC(=O)CCCCCCCC
|
|
| MolPort-003-855-484 |
0.82 |
CCCCCCCCC1CCC2C3CC=C4CC(CCC4(C)C3CCC12C)OC(=O)CCCCCC
|
|
| MolPort-003-855-492 |
0.82 |
CCCCCCCCC1CCC2C3CC=C4CC(CCC4(C)C3CCC12C)OC(=O)CCCCCCC
|
|
| MolPort-002-501-638 |
0.82 |
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-002-511-119 |
0.82 |
CCCCCCCCC1CCC2C3CC=C4C[C@H](CC[C@]4(C)C3CC[C@]12C)OC(=O)CCCCCCC
|
|
| MolPort-046-594-654 |
0.82 |
CCCCCCCCC1CCC2C3CC=C4CC(CCC4(C)C3CCC12C)OC(=O)CCC1CCCCC1
|
|
| MolPort-002-810-756 |
0.82 |
CC(C)CCCC(C)C1CCC2C3CC=C4CC(CCC4(C)C3CCC12C)OC(=O)CCC1CCCCC1
|
|
| MolPort-002-911-094 |
0.82 |
CC(=O)OC1CCC2(C)C3CCC4(C)C(CCC4C(=O)OC4CC5CCC4C5)C3CC=C2C1
|
|
| MolPort-003-388-177 |
0.82 |
CCCCCCC(=O)OC1CCC2(C)C3CCC4(C)C(CCC4=O)C3CC=C2C1
|
|
| MolPort-002-510-031 |
0.82 |
CCCCCCCCCC(=O)O[C@H]1CC[C@]2(C)C3CC[C@]4(C)C(CCCCCCCC)CCC4C3CC=C2C1
|
|
| MolPort-002-507-129 |
0.82 |
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-002-510-156 |
0.82 |
CCCCCCCCC1CCC2C3CC=C4C[C@H](CC[C@]4(C)C3CC[C@]12C)OC(=O)CC1CCCCC1
|
|
| MolPort-002-502-001 |
0.82 |
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-035-706-294 |
0.82 |
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-046-594-655 |
0.82 |
CCCCCCCCC1CCC2C3CC=C4CC(CCC4(C)C3CCC12C)OC(=O)C12CC3CC(CC(C3)C1)C2
|
|
| MolPort-003-721-672 |
0.82 |
CC(C)CCCC(C)C1CCC2C3CC=C4CC(CCC4(C)C3CCC12C)OC(=O)C1CCCC1
|
|
| MolPort-002-501-660 |
0.82 |
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 |
0.82 |
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-003-710-687 |
0.82 |
CC(C)CCCC(C)C1CCC2C3CC=C4CC(CCC4(C)C3CCC12C)OC(=O)C12CC3CC(CC(C3)C1)C2
|
|
| MolPort-002-501-639 |
0.82 |
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-002-530-244 |
0.82 |
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-002-501-637 |
0.82 |
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-046-596-340 |
0.82 |
C[C@@H]1CC2C3CC=C4CC(CC[C@]4(C)C3CC[C@]2(C)[C@@]1(O)C(C)=O)OC(C)=O
|
|
| MolPort-002-319-532 |
0.82 |
CC(=O)OC1CCC2(C)C3CCC4(C)C(CC[C@]4(O)C(C)=O)C3CC=C2C1
|
|
| MolPort-003-855-497 |
0.82 |
CCCCCCCCCCC(=O)OC1CCC2(C)C3CCC4(C)C(CCCCCCCC)CCC4C3CC=C2C1
|
|
| MolPort-006-124-217 |
0.82 |
CCCCCCC(=O)O[C@H]1CC[C@]2(C)[C@H]3CC[C@@]4(C)[C@@H](CCC4=O)[C@@H]3CC=C2C1
|
|
| MolPort-003-855-503 |
0.82 |
CCCCCCCCC1CCC2C3CC=C4CC(CCC4(C)C3CCC12C)OC(=O)CC1CCCCC1
|
|
| MolPort-003-940-792 |
0.82 |
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-000-795-108 |
0.82 |
CCCCCCCCCCC(=O)O[C@H]1CC[C@]2(C)C3CC[C@]4(C)C(CCCCCCCC)CCC4C3CC=C2C1
|
|
| MolPort-000-790-894 |
0.82 |
CCCCCCCCCCCC(=O)O[C@H]1CC[C@]2(C)C3CC[C@]4(C)C(CCCCCCCC)CCC4C3CC=C2C1
|
|
| MolPort-003-893-546 |
0.82 |
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-003-893-547 |
0.82 |
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-003-928-863 |
0.82 |
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-000-778-228 |
0.82 |
CCCCCCCCCCCCC(=O)O[C@H]1CC[C@]2(C)C3CC[C@]4(C)C(CCCCCCCC)CCC4C3CC=C2C1
|
|
| MolPort-042-646-612 |
0.82 |
CCCCCCCCC1CCC2C3CC=C4C[C@H](CC[C@]4(C)C3CC[C@]12C)OC(=O)CCC1CCCCC1
|
|
| MolPort-000-758-136 |
0.82 |
CCCCCCCCCCCCCC(=O)O[C@H]1CC[C@]2(C)C3CC[C@]4(C)C(CCCCCCCC)CCC4C3CC=C2C1
|
|
| MolPort-003-940-763 |
0.82 |
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-002-529-036 |
0.82 |
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-003-855-540 |
0.82 |
CCCCCCCCCC(=O)OC1CCC2(C)C3CCC4(C)C(CCCCCCCC)CCC4C3CC=C2C1
|
|
| MolPort-006-069-075 |
0.82 |
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-002-528-936 |
0.82 |
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-002-526-154 |
0.82 |
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-002-528-527 |
0.82 |
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-000-295-010 |
0.82 |
CCCCCCCCCCCCCCCCCC(=O)OC1CCC2(C)C3CCC4(C)C(CCC4C3CC=C2C1)C(C)CCCC(C)C
|
|
| MolPort-000-295-004 |
0.82 |
CCCCCCC(=O)OC1CCC2(C)C3CCC4(C)C(CCC4C3CC=C2C1)C(C)CCCC(C)C
|
|
| MolPort-000-295-002 |
0.82 |
CCCCCCCCC(=O)OC1CCC2(C)C3CCC4(C)C(CCC4C3CC=C2C1)C(C)CCCC(C)C
|
|
| MolPort-000-294-998 |
0.82 |
CCCCCCCCCCCCCC(=O)OC1CCC2(C)C3CCC4(C)C(CCC4C3CC=C2C1)C(C)CCCC(C)C
|
|
| MolPort-000-294-992 |
0.82 |
CCCCCCCCCCC(=O)OC1CCC2(C)C3CCC4(C)C(CCC4C3CC=C2C1)C(C)CCCC(C)C
|
|
| MolPort-003-855-546 |
0.82 |
CCCCCCCCCCCCCC(=O)OC1CCC2(C)C3CCC4(C)C(CCCCCCCC)CCC4C3CC=C2C1
|
|
| MolPort-000-767-609 |
0.82 |
CCCCCCCCCCCCCCCC(=O)O[C@H]1CC[C@]2(C)C3CC[C@]4(C)C(CCCCCCCC)CCC4C3CC=C2C1
|
|
| MolPort-007-980-856 |
0.82 |
C[C@@H]1CC2C3CC=C4CC(CCC4(C)C3CCC2(C)[C@@]1(O)C(C)=O)OC(C)=O
|
|
| MolPort-000-836-412 |
0.82 |
CC(=O)OC1CC[C@]2(C)C3CC[C@@]4(C)C(CC[C@]4(O)C(C)=O)C3CC=C2C1
|
|
| MolPort-003-855-519 |
0.82 |
CCCCCCCCC1CCC2C3CC=C4CC(CCC4(C)C3CCC12C)OC(=O)CCCCCCCC
|
|
| MolPort-001-793-906 |
0.82 |
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-002-530-234 |
0.82 |
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-008-346-684 |
0.82 |
CCCCCCCCC1CCC2C3CC=C4C[C@H](CC[C@]4(C)C3CC[C@]12C)OC(=O)C12CC3C[C@@H](CC(C3)C1)C2
|
|
| MolPort-002-530-141 |
0.82 |
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-003-855-530 |
0.82 |
CCCCCCCCC1CCC2C3CC=C4CC(CCC4(C)C3CCC12C)OC(=O)CCCCC
|
|
| MolPort-003-855-505 |
0.82 |
CCCCCCCCCCCCC(=O)OC1CCC2(C)C3CCC4(C)C(CCCCCCCC)CCC4C3CC=C2C1
|
|
| MolPort-003-855-514 |
0.82 |
CCCCCCCCC1CCC2C3CC=C4CC(CCC4(C)C3CCC12C)OC(=O)C1CCCC1
|
|
| MolPort-002-529-701 |
0.82 |
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-003-855-532 |
0.82 |
CCCCCCCCCCCC(=O)OC1CCC2(C)C3CCC4(C)C(CCCCCCCC)CCC4C3CC=C2C1
|
|
| MolPort-001-593-439 |
0.82 |
CCCCCCC(=O)OC1CC[C@]2(C)C3CC[C@@]4(C)C(CCC4=O)C3CC=C2C1
|
|
| MolPort-046-762-539 |
0.82 |
CC(=O)O[C@H]1CC[C@]2(C)[C@@H]3CC[C@]4(C)[C@@H](O)CC=C4[C@@H]3CC=C2C1
|
|
| MCULE-2597929771 |
0.81 |
O(C12CC(O)CCC1(C)C1CCC3(C)C(C(C)C=CC(C)C(C)C)CCC3C1=CC2)C(C)=O
|
|
| MCULE-1443616160 |
0.81 |
CC1C(CCC2COC(=O)C=2)(C)C2CC(O)C=C(CO)C2(COC(C)=O)CC1
|
|
| MCULE-2606384678 |
0.81 |
[C@@H]1(C[C@@]2([H])[C@@](C(CO)=C1)(COC(C)=O)CC[C@@H](C)[C@]2(C)CCC1=CC(=O)OC1)O
|
|
| MCULE-9210235948 |
0.81 |
C12CC=C3CC(CCC3(C)C1CCC1(C)C(CCC21)C(C)CCC(=O)OC1CC2CC1C=CC2)O
|
|
| MCULE-4238584773 |
0.81 |
C12(C)CCC(CC1=CCC1C2CCC2(C1CCC2C#N)C)OC(C)=O
|
|
| MCULE-1153848413 |
0.81 |
C12(C)C(=O)C(=C)CC1C1C(CC2)C2(C)CCC(CC2=CC1)OC(C)=O
|
|
| MCULE-6532690267 |
0.81 |
[C@]12(C)CC[C@@H](CC1=CC[C@]1([H])[C@]2([H])CC[C@]2([C@@]1([H])CC[C@@H]2C#N)C)OC(C)=O
|
|
| MolPort-044-755-223 |
0.81 |
CC(=O)O[C@@H]1C[C@H]2[C@@H]3CC=C4C[C@H](CC[C@]4(C)[C@H]3CC[C@]2(C)[C@H]1OC(C)=O)OC(C)=O
|
|
| MolPort-046-761-616 |
0.81 |
[Na+].CCC(C)(C)C(=O)O[C@@H]1C[C@H](C)[C@H](O)C2=C[C@H](O)[C@H](C)[C@H](CC[C@H](O)C[C@H](O)CC([O-])=O)[C@@H]12
|
|
| MolPort-046-764-836 |
0.81 |
[Na+].CCC(C)(C)C(=O)O[C@H]1C[C@@H](C)C(O)C2=CC(O)[C@H](C)[C@H](CC[C@@H](O)C[C@@H](O)CC([O-])=O)[C@@H]12
|
|
| MolPort-030-042-311 |
0.81 |
CC(=O)OC1CCC2(C)C3CCC4(C)C(CCC4C3CC=C2C1)C#N
|
|
| MolPort-002-893-940 |
0.81 |
CC(CCC(=O)OC1CC2CC1C=CC2)C1CCC2C3CC=C4CC(O)CCC4(C)C3CCC12C
|
|
| MolPort-002-510-630 |
0.81 |
CC(=O)OC1CC[C@]2(C)C3CC[C@]4(C)C(CCC4C3CC=C2C1)C#N
|
|
| MolPort-002-507-145 |
0.81 |
CC(=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#N
|
|
| MolPort-009-649-408 |
0.80 |
CC(C)CCC[C@@H](C)[C@H]1CCC2[C@@H]3CC=C4C[C@H](CC[C@]4(C)C3CC[C@]12C)OC=O
|
|
| MolPort-046-596-377 |
0.80 |
CC(C)CCCC(C)C1CCC2C3CC=C4CC(CC[C@]4(C)C3CC[C@]12C)OC=O
|
|
| MolPort-002-911-120 |
0.80 |
CC(=O)OC1CCC2=C3CCC4(C)CCCC4C3CC(OC(C)=O)C2(C)C1
|
|
| MolPort-002-911-119 |
0.80 |
CC(C)CCCC(C)C1CCC2C3CC(OC(C)=O)C4(C)CC(O)CCC4=C3CCC12C
|
|
| MCULE-2424380947 |
0.80 |
[C@]12(C)CCC3[C@@]([H])(CC=C4C[C@@H](OC=O)CC[C@]34C)C1CC[C@]2([H])[C@H](C)CCCC(C)C
|
|
| MCULE-1548167049 |
0.80 |
C(=O)OC1CCC2(C)C3CCC4(C)C(C(C)CCCC(C)C)CCC4C3CC=C2C1
|
|
| MCULE-3323781979 |
0.80 |
C12CC(C3(C)CC(CCC3=C1CCC1(C)CCCC21)OC(=O)C)OC(=O)C
|
|
| MCULE-9352894910 |
0.80 |
C12CC(C3(C)CC(CCC3=C1CCC1(C)C(CCC21)C(C)CCCC(C)C)O)OC(=O)C
|
|
| MCULE-3605854604 |
0.80 |
C12(C)CCC3C(CC=C4CC(CCC34C)OC(=O)C(C)=C([H])C)C1CCC2C(C)CCCC(C)C
|
|
| MCULE-7272779592 |
0.80 |
[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(=O)C(C)=CC
|
|
| MCULE-3193343372 |
0.80 |
C12(C)CCC(CC1=CCC1C2CCC2(C1CCC2CCCCCCCC)C)OC(=O)C(C)=CC
|
|
| MCULE-4710541318 |
0.80 |
[C@]12(C)CCC3C(CC=C4CC(CC[C@]34C)OC(C)=O)C1C[C@@H](O)[C@]2(O)C#N
|
|
| MCULE-4601889192 |
0.80 |
C(C)(=O)OC1CCC2(C)C(C1)(CC=C1C3CCC(C(C)C=CC(C)C(C)C)C3(C)CCC21)OC(C)=O
|
|
| MolPort-003-855-493 |
0.80 |
CCCCCCCCC1CCC2C3CC=C4CC(CCC4(C)C3CCC12C)OC(=O)C(\C)=C/C
|
|
| MolPort-002-530-359 |
0.80 |
CCCCCCCC[C@H]1CC[C@H]2[C@@H]3CC=C4C[C@H](CC[C@]4(C)[C@H]3CC[C@]12C)OC(=O)C(\C)=C/C
|
|
| MolPort-003-712-637 |
0.80 |
C\C=C(/C)C(=O)OC1CCC2(C)C3CCC4(C)C(CCC4C3CC=C2C1)C(C)CCCC(C)C
|
|
| MolPort-042-646-608 |
0.80 |
CCCCCCCCC1CCC2C3CC=C4C[C@H](CC[C@]4(C)C3CC[C@]12C)OC(=O)C(\C)=C/C
|
|
| MolPort-002-511-845 |
0.80 |
CC(=O)OC1CC[C@]2(C)C3CC[C@@]4(C)C(C[C@@H](O)[C@]4(O)C#N)C3CC=C2C1
|
|
| MolPort-030-042-312 |
0.79 |
CC(=O)OC1CCC2(C)C3CCC4(C)C(CCC4(O)C#N)C3CC=C2C1
|
|
| MolPort-000-712-243 |
0.79 |
CC(=O)OC1CCC2(C)C3CCC4(C)C(CC[C@@]4(O)C#N)C3CC=C2C1
|
|
| MolPort-002-507-148 |
0.79 |
CC(=O)O[C@H]1CC[C@]2(C)[C@H]3CC[C@@]4(C)[C@@H](CC[C@@]4(O)C#N)[C@@H]3CC=C2C1
|
|
| MolPort-000-692-409 |
0.79 |
CC(=O)OC1CCC2(C)C3CCC4(C)C(CCC4C4(C)CCC(=O)O4)C3CC=C2C1
|
|
| MolPort-002-509-633 |
0.79 |
CC(=O)O[C@@H]1CC[C@]2(C)C3CC[C@@]4(C)C(CC5CC=CCC45C(C)=O)C3CC=C2C1
|
|
| MolPort-002-508-597 |
0.79 |
C[C@H]1[C@H]2[C@H](CC3[C@@H]4CC=C5C[C@H](CC[C@]5(C)C4CC[C@]23C)OC(C)=O)OC1=O
|
|
| MolPort-035-946-557 |
0.79 |
CC(=O)O[C@H]1CC[C@]2(C)[C@H]3CC[C@@]4(C)[C@@H](CC[C@H]4C4(C)CCC(=O)O4)[C@@H]3CC=C2C1
|
|
| MolPort-001-569-829 |
0.79 |
CC(=O)O[C@H]1CC[C@]2(C)C3CC[C@@]4(C)C(CCC4C4(C)CCC(=O)O4)C3CC=C2C1
|
|
| MolPort-000-826-231 |
0.79 |
CC(=O)OC1CC[C@]2(C)C3CC[C@@]4(C)C(CC[C@@]4(O)C#N)C3CC=C2C1
|
|
| MolPort-002-529-441 |
0.79 |
CC(=O)O[C@H]1CC[C@]2(C)[C@H]3CC[C@@]4(C)[C@@H](CC[C@@H]4C4(C)CCC(=O)O4)[C@@H]3CC=C2C1
|
|
| MolPort-002-529-258 |
0.79 |
CC(=O)OC1CC[C@]2(C)[C@H]3CC[C@@]4(C)[C@@H](CC[C@]4(O)C#N)[C@@H]3CC=C2C1
|
|
| MolPort-002-510-278 |
0.79 |
CC(=O)OC1CC[C@]2(C)C3CC[C@@]4(C)C(CC[C@]4(O)C#N)C3CC=C2C1
|
|
| MolPort-002-139-577 |
0.79 |
CC(=O)OC1CCC2(C)C3CCC4(C)C(CC5CC=CCC45C(C)=O)C3CC=C2C1
|
|
| MolPort-019-936-929 |
0.79 |
CC(CCC1=C(C)C(O)C(OC(C)=O)C2C(C)(C)CCCC12C)CC(O)=O
|
|
| MolPort-044-755-195 |
0.79 |
CC(=O)O[C@H]1CC[C@]2(C)[C@H]3CC[C@@]4(C)[C@@H](CCC4=O)[C@@H]3C=C2C1
|
|
| MCULE-4359391178 |
0.79 |
C12(C)CCC3C(CC=C4CC(CCC34C)OC(C)=O)C1CC1([H])CC=CCC21C(C)=O
|
|
| MCULE-8554570348 |
0.79 |
C12(C)CCC(CC1=CCC1C2CCC2(C1CCC2(O)C#N)C)OC(C)=O
|
|
| MCULE-3623108676 |
0.79 |
[C@]12(C)CCC3[C@@]([H])(CC=C4C[C@H](CC[C@]34C)OC(C)=O)C1C[C@@H]1OC(=O)[C@@H](C)[C@]21[H]
|
|
| MCULE-8580808454 |
0.79 |
[C@]12(C)CC[C@@H](CC1=CC[C@]1([H])[C@]2([H])CC[C@]2([C@@]1([H])CC[C@@]2(O)C#N)C)OC(C)=O
|
|
| MCULE-3364249229 |
0.79 |
C(CC(=O)OC1CCC2(C)C3C(CC=C2C1)C1CCC(C(C)CCCC(C)C)C1(C)CC3)(C)=O
|
|
| MCULE-6754625100 |
0.79 |
C(C)(=O)OC1CCC2(C)C3CCC4(C)C(CCC4C3CC=C2C1)C(COC(C)=O)([H])OC(C)=O
|
|
| MCULE-7919639616 |
0.79 |
C12(C)CCC3C(CC=C4CC(CCC34C)OC(C)=O)C1CCC2C1(C)CCC(=O)O1
|
|
| MCULE-2487519401 |
0.79 |
C(C)(=O)OC1CCC2(C)C3CCC4(C(CCC4C=3C(C3C=C4CC(OC(=O)C)CCC4(C)C4CCC5(C)C(C(C)C=CC(C)C(C)C)CCC5C3=4)C=C2C1)C(C)C=CC(C)C(C)C)C
|
|
| MCULE-2484673307 |
0.79 |
[C@]12(C)CCC(CC1=CCC1C2CC[C@]2(C1CC[C@@]2(O)C#N)C)OC(C)=O
|
|
| MCULE-1459395786 |
0.79 |
C1CC2(C)C(CCC(CC(O)=O)C)=C(C)C(O)C(OC(=O)C)C2C(C)(C)C1
|
|
| MCULE-2895344878 |
0.79 |
C(C)(=O)OC1CCC2(C)C3CCC4(C)C(CCC4C3C=C2C1)=O
|
|
| MCULE-3543018898 |
0.79 |
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
|
|
| MolPort-039-339-228 |
0.79 |
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-007-549-249 |
0.78 |
CC(C)CCCC(C)C1CCC2C3CC=C4CC(CCC4(C)C3CCC12C)OC(=O)C(C)I
|
|
| MolPort-002-509-263 |
0.78 |
CC(=O)OC1CC[C@]2(C)C3CC[C@@]4(C)C(C[C@H]5O[C@@]45O)C3CC=C2C1
|
|
| MolPort-002-731-964 |
0.78 |
CC(C)CCCC(C)C1CCC2C3CC=C4CC(CCC4(C)C3CCC12C)OC(=O)CC(C)I
|
|
| MolPort-001-762-698 |
0.78 |
CC(=O)OC1CC2CC1C=C2
|
|
| MolPort-035-769-972 |
0.78 |
CC(=O)OC1C[C@@H]2C[C@H]1C=C2
|
|
| MolPort-046-594-618 |
0.78 |
CCCCCCCCC1CCC2C3CC=C4CC(CCC4(C)C3CCC12C)OC(=O)CCl
|
|
| MolPort-002-511-923 |
0.78 |
CC(C)CCC[C@@H](C)[C@H]1CC[C@H]2C3CC=C4C[C@H](CC[C@]4(C)[C@H]3CC[C@]12C)OC(=O)CCl
|
|
| MolPort-006-113-345 |
0.78 |
CC(C)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(=O)CCC(O)=O
|
|
| MolPort-003-892-829 |
0.78 |
CC(C)CCCC(C)C1CCC2C3CC=C4CC(CCC4(C)C3CCC12C)OC(=O)CCC(O)=O
|
|
| MolPort-004-947-162 |
0.78 |
CC(C)CCCC(C)C1CCC2C3CC=C4CC(CCC4(C)C3CCC12C)OC(=O)CCl
|
|
| MolPort-002-507-136 |
0.78 |
CC(C)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(=O)CCl
|
|
| MolPort-002-529-404 |
0.78 |
CCCCCCCC[C@H]1CC[C@H]2[C@@H]3CC=C4C[C@H](CC[C@]4(C)[C@H]3CC[C@]12C)OC(=O)CCl
|
|
| MolPort-044-755-247 |
0.78 |
CC(=O)O[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
|
|
| MCULE-5177446419 |
0.78 |
C(C)(=O)OC1CCC2(C)C(C1)(CCC1=C3CCC(C(C)CCC(C)C(C)C)C3(C)CC(O)C21)[H]
|
|
| MCULE-9012319989 |
0.78 |
C12(C)CCC3C(CC=C4CC(CCC34C)OC(C(C)I)=O)C1CCC2C(C)CCCC(C)C
|
|
| MCULE-6579743305 |
0.78 |
C1CC2(C)C(CC1OC(CC(I)C)=O)=CCC1C3C(C)(CCC21)C(C(C)CCCC(C)C)CC3
|
|
| MCULE-5236688455 |
0.78 |
[C@]12(O)[C@H](O1)CC1C3C(CC[C@]21C)[C@@]1(C)CCC(CC1=CC3)OC(C)=O
|
|
| MCULE-2871410677 |
0.78 |
C(C)(=O)OC1CC(C2(C)C3CCC4(C)C(CCC4C3CC=C2C1)C(C)=O)OC(C)=O
|
|
| MCULE-9872247716 |
0.78 |
C1(CC2CC1C=C2)OC(C)=O
|
|
| MCULE-2553518631 |
0.78 |
C(C)(=O)OC1CCC2(C)C3(C1)CCC1(C4CCC(C(C)CCC(C)C(C)C)C4(C)CC=C21)O3
|
|
| MCULE-1191180792 |
0.78 |
C(C)(=O)OC1CCC2(C)C3C(CC4(C)C(CCC4C3CC=C2C1)=O)=O
|
|
| MCULE-3927730358 |
0.78 |
C(CCl)(=O)OC1CCC2(C)C3CCC4(C)CCCC4C3CC=C2C1
|
|
| MCULE-6313611389 |
0.78 |
[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(CCl)=O
|
|
| MCULE-6357156788 |
0.78 |
C12(C)CCC3(C([H])(CC=C4CC(CCC34C)OC(CCl)=O)C1([H])CCC2([H])C(C)CCCC(C)C)[H]
|
|
| MCULE-5886720027 |
0.78 |
C(C)(=O)OC1CCC2(C)C3CCC4(C)C(CCC4C3CC=C2C1)C(COC(C)=O)=O
|
|
| MCULE-8345937454 |
0.78 |
[C@@]12([H])CC=C3C[C@@H](OC(=O)CCC(=O)O)CC[C@]3(C)[C@@]1([H])CC[C@]1(C)[C@H](CC[C@@]21[H])[C@H](C)CCCC(C)C
|
|
| MCULE-5546761279 |
0.78 |
C(CCC(=O)OC1CCC2(C)C3CCC4(C)C(C(C)CCCC(C)C)CCC4C3CC=C2C1)(OC)=O
|
|
| MCULE-7163756961 |
0.78 |
O=C(C(F)(F)F)OC1CCC2(C)C3CCC4(C)CCCC4C3CC=C2C1
|
|
| MCULE-5079538770 |
0.78 |
C1CC2(C)C3([H])CCC4(C)C([H])(C(CCCC(C)C)C)CCC4([H])C3([H])CC=C2CC1OC(CCC(=O)OCC)=O
|
|
| MCULE-2699479252 |
0.78 |
[C@]12(C)CC[C@]3([C@@]([H])(CC=C4C[C@H](CC[C@]34C)OC(CCl)=O)[C@]1([H])CC[C@]2([H])[C@H](C)CCCC(C)C)[H]
|
|
| MCULE-4699905911 |
0.78 |
C12(C)CCC(CC1=CCC1C2CCC2(C1CCC2CCCCCCCC)C)OC(CCl)=O
|
|
| MCULE-5244359815 |
0.78 |
C(CBr)(=O)OC1CCC2(C)C3CCC4(C)CCCC4C3CC=C2C1
|
|
| MCULE-3981843538 |
0.78 |
C12(C)CCC(CC1=CCC1C(C(C)CCC21)=O)OC(C)=O
|
|
| MCULE-7037894510 |
0.78 |
[C@]12(C)CCC(CC1=CCC1C(C(C)CCC21)=O)OC(C)=O
|
|
| MCULE-2147966582 |
0.78 |
[C@]12(O)CC[C@@H]([C@@]1(C)CCC1[C@@]2([H])CCC2[C@]1(CO)CC[C@H](O)C=2)C1COC(=O)C=1
|
|
| MolPort-001-569-828 |
0.78 |
CC1CCC2C(CC=C3CC(CC[C@]23C)OC(C)=O)C1=O
|
|
| MolPort-002-508-407 |
0.78 |
CC1[C@@H]2COC[C@@]1(COC(C)=O)CC1C2=CCCC1(C)C
|
|
| MolPort-002-525-135 |
0.78 |
C[C@]12CCC3[C@@H](CCC4=C[C@@H](O)CC[C@]34CO)[C@@]1(O)CC[C@@H]2C1=CC(=O)OC1
|
|
| MolPort-046-764-837 |
0.77 |
CCC(C)(C)C(=O)O[C@H]1C[C@@H](C)C(O)C2=CC(O)[C@H](C)[C@H](CC[C@@H]3C[C@@H](O)CC(=O)O3)[C@@H]12
|
|
| MolPort-046-158-407 |
0.77 |
CC(=O)O[C@H]1CC[C@@]2(C)[C@@H](CC[C@]3(C)[C@@H]2[C@@H]2O[C@@H]2[C@@]2(C)[C@@H]4CC(C)(C)CC[C@]4(C)CC=C32)C1(C)C
|
|
| MCULE-8025116603 |
0.77 |
C(C)(=O)OC1CCC2(C)C3CCC4(C)C(C(C)CCCC(C)C)CCC4C3CC=C2C1OC(C)=O
|
|
| MCULE-7816980935 |
0.77 |
CC(OC1C(O)C2=CC(C3C(C2(C)CC1)CCC1(C)C3CCC1)=O)=O
|
|
| MCULE-9558386116 |
0.77 |
[C@@]12([H])CC=C3C[C@@H](OC(=O)CCCCCCC/C=C\C/C=C\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-9931270158 |
0.77 |
C(C(Cl)Cl)(=O)OC1CCC2(C)C3CCC4(C)CCCC4C3CC=C2C1
|
|
| MCULE-5585134478 |
0.77 |
[C@@]12([H])CC=C3C[C@@H](OC(=O)CCCCCCCC=CCC=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-6809618026 |
0.77 |
C(C)(=O)OC1CCC2(C)C3CCC4(C)C(C(CC4C3CC=C2C1)OC(C)=O)=O
|
|
| MCULE-2112245744 |
0.77 |
CCCCCC[C@](CC=CCCCCCCCC(OC)=O)(OC(C)=O)[H]
|
|
| MolPort-044-727-765 |
0.77 |
CCCCC\C=C/C\C=C/C\C=C/C\C=C/CCCC(=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-046-426-236 |
0.77 |
CC\C=C/C\C=C/C\C=C/C\C=C/C\C=C/CCCC(=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-046-156-814 |
0.77 |
CC(=O)O[C@H]1CC[C@]2(C)[C@H]3CC[C@@]4(C)[C@@H](CCC44OCCO4)[C@@H]3CC=C2C1
|
|
| MolPort-006-112-040 |
0.77 |
CCCCC\C=C/C\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-046-426-235 |
0.77 |
CC\C=C/C\C=C/C\C=C/C\C=C/C\C=C/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-006-114-478 |
0.77 |
CC\C=C/C\C=C/C\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-035-706-325 |
0.77 |
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-035-706-303 |
0.77 |
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-044-755-261 |
0.77 |
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-000-775-527 |
0.76 |
CCCCCCCCC1CCC2C3CC=C4C[C@H](CC[C@]4(C)C3CC[C@]12C)OC(=O)C(\C)=C(/C)C(=O)O[C@@H]1CC[C@@]2(C)C3CC[C@@]4(C)C(CCCCCCCC)CCC4C3CC=C2C1
|
|
| MolPort-044-755-222 |
0.76 |
CC(=O)O[C@H]1CC[C@]2(C)[C@H]3CC[C@@]4(C)[C@@H](CC5OC(C)(C)OC45)[C@@H]3CC=C2C1
|
|
| MolPort-001-742-274 |
0.76 |
C[C@@H]1CC[C@@H](\C=C(/C)C(O)=O)C2=C(C)C[C@@H](OC(C)=O)[C@H]12
|
|
| MolPort-002-528-190 |
0.76 |
CCCCCCCCC1CCC2C3CC=C4C[C@@H](CC[C@@]4(C)C3CC[C@@]12C)OC(=O)C(\C)=C(/C)C(=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-027-641-219 |
0.76 |
CCCCC[C@H](O)\C=C\[C@H]1C2CC(CO2)[C@@H]1CCCCCCC(O)=O
|
|
| MolPort-005-945-460 |
0.76 |
C[C@]12CCC3[C@@H](CC=C4C[C@@H](O)CC[C@]34C)[C@@]1(O)CC[C@@H]2C1=CC(=O)OC1
|
|
| MolPort-039-338-125 |
0.76 |
C[C@H](CC\C=C(/C)C(O)=O)[C@H]1C[C@H](OC(C)=O)[C@@]2(C)C3=CCC4C(C)(C)[C@@H](O)CC[C@]4(C)C3=CC[C@]12C
|
|
| MCULE-3655756453 |
0.76 |
[C@@H]1(/C=C(\C)/C(O)=O)CC[C@@H](C)[C@@]2([H])[C@@H](CC(=C21)C)OC(C)=O
|
|
| MCULE-1077978348 |
0.76 |
[C@]12(C)CC[C@@H](CC1=CCC1C2CC[C@]2(C1CCC2CCCCCCCC)C)OC(=O)C(C)=C(C)C(=O)O[C@@H]1CC[C@@]2(C(=CCC3C2CC[C@@]2(C3CCC2CCCCCCCC)C)C1)C
|
|
| MCULE-1720134200 |
0.76 |
C(CI)(=O)OC1CCC2(C)C3CCC4(C)C(CCC4C3CC=C2C1)=O
|
|
| MCULE-7783153626 |
0.76 |
C(C)(=O)OC1CCC2(C)C(O)(C1)CC=C1C3CCC(C(C)C=CC(C)C(C)C)C3(C)CCC12[H]
|
|
| MCULE-5472477242 |
0.76 |
C(C)(=O)OC1CC2=C3C4C(C5CCCC5C3C3C5CCC(C5(C)CCC3C2(C)CC1)C(OC(C1C2C3C5CCC6CCC7(C)CC(CC(=O)C)CCC7=C6C5C5(C)CC(CC(=O)C)CCC5=C3CCC2CC1)=O)=O)CC=C1CC(CCC14C)OC(C)=O
|
|
| MCULE-3351915633 |
0.76 |
C12(C)CCC3C(CC=C4CC(CCC34C)OC(=O)C(C)(C)Br)C1CCC2C(C)CCCC(C)C
|
|
| MCULE-6247777566 |
0.76 |
C1CC2(C3C(C(=O)C=C2CC1OC(C)=O)C1CCC(C(CCCC(C)C)C)C1(C)CC3)C
|
|
| MCULE-5067610229 |
0.76 |
C(CCC(=O)OC1CCC2(C)C3CCC4(C)C(CCC4C3CC=C2C1)C(OC)=O)(O)=O
|
|
| MCULE-7048891368 |
0.76 |
C12(C)CCC3C(CC=C4CC(CCC34C)OC(=O)CC(F)(F)F)C1CCC2C(C)CCCC(C)C
|
|
| MCULE-6349353177 |
0.76 |
C12(C)CCC3C(CC=C4CC(CCC34C)OC(C(C)Br)=O)C1CCC2C(C)CCCC(C)C
|
|
| MCULE-5053602152 |
0.76 |
[C@]12(C)CCC3C(CC=C4C[C@H](CC[C@]34C)OC(C(C)Br)=O)C1CC[C@]2([H])[C@H](C)CCCC(C)C
|
|
| MCULE-3038975638 |
0.76 |
C12(C)CCC3C(CC=C4CC(CCC34C)OC(C(C)Cl)=O)C1CCC2C(C)CCCC(C)C
|
|
| MCULE-8770472130 |
0.76 |
C(C)(=O)OC1CCC2(C)C3CCC4(C)C(CCC4C3C(C=C2C1)=O)C(C)=O
|
|
| MCULE-5487707656 |
0.76 |
C12(C)CCC3C(CC=C4CC(CCC34C)OC(=O)CCBr)C1CCC2C(C)CCCC(C)C
|
|
| MCULE-1931440399 |
0.76 |
[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(=O)C(C)(C)Br
|
|
| MCULE-7921441859 |
0.76 |
C(C)(=O)OC1CCC2(C)C3CCC4(C)C(CCC4C3CC=C2C1)(C#C)OC(C)=O
|
|
| MCULE-2983690182 |
0.76 |
C(C)(=O)OC1CCC2(C)C3CCC4(C)CCCC4C3C(C=C2C1)=O
|
|
| MCULE-7968591564 |
0.76 |
[C@]12(C)CC[C@@H](CC1=CCC1C2CC[C@]2(C1CCC2CCCCCCCC)C)OC(=O)CC(F)(F)F
|
|
| MCULE-5176587980 |
0.76 |
[C@]12(C)CCC(CC1=CCC1C2CC[C@]2(C1CCC2=O)C)OC(CCC(O)=O)=O
|
|
| MCULE-4024956051 |
0.76 |
[C@]12(C)CCC3[C@@]([H])(C(=O)C=C4C[C@H](CC[C@]34C)OC(C)=O)C1CC[C@]2([H])[C@H](C)CCCC(C)C
|
|
| MCULE-4513472403 |
0.76 |
[C@]12(C)CC[C@@H](CC1=CCC1C2CC[C@]2(C1CCC2CCCCCCCC)C)OC(=O)CCCl
|
|
| MCULE-9020843608 |
0.76 |
[C@]12(C)CC[C@@H](CC1=CCC1C2CC[C@]2(C1CCC2CCCCCCCC)C)OC(C(C)Cl)=O
|
|
| MCULE-6395225361 |
0.76 |
C12(C)CCC3C(CC=C4CC(CCC34C)OC(=O)CCCl)C1CCC2C(C)CCCC(C)C
|
|
| MolPort-002-530-177 |
0.76 |
CCCCCCCC[C@H]1CC[C@H]2[C@@H]3CC=C4C[C@H](CC[C@]4(C)[C@H]3CC[C@]12C)OC(=O)C(C)(C)Br
|
|
| MolPort-007-549-250 |
0.76 |
CC(C)CCCC(C)C1CCC2C3CC=C4CC(CCC4(C)C3CCC12C)OC(=O)C(C)(C)Br
|
|
| MolPort-002-508-666 |
0.76 |
CCCCCCCCC1CCC2C3CC=C4C[C@H](CC[C@]4(C)C3CC[C@]12C)OC(=O)CC(F)(F)F
|
|
| MolPort-046-597-623 |
0.76 |
CC(C)CCCC(C)C1CCC2C3CC=C4C[C@H](CC[C@]4(C)C3CC[C@]12C)OC(=O)C(C)Br
|
|
| MolPort-002-798-662 |
0.76 |
CC(C)CCCC(C)C1CCC2C3CC=C4CC(CCC4(C)C3CCC12C)OC(=O)CCBr
|
|
| MolPort-002-510-591 |
0.76 |
CC(C)CCC[C@@H](C)[C@H]1CCC2[C@H]3C(CC[C@]12C)[C@@]1(C)CC[C@@H](CC1=CC3=O)OC(C)=O
|
|
| MolPort-027-849-841 |
0.76 |
CC(C)CCCC(C)C1CC[C@H]2C3[C@H](CC[C@]12C)[C@@]1(C)CC[C@H](CC1=CC3=O)OC(C)=O
|
|
| MolPort-009-649-072 |
0.76 |
CC(C)CCC[C@@H](C)[C@H]1CCC2C3CC=C4C[C@H](CC[C@]4(C)C3CC[C@]12C)OC(=O)C(C)Br
|
|
| MolPort-002-510-231 |
0.76 |
CCCCCCCCC1CCC2C3CC=C4C[C@H](CC[C@]4(C)C3CC[C@]12C)OC(=O)C(C)Cl
|
|
| MolPort-007-549-247 |
0.76 |
CC(C)CCCC(C)C1CCC2C3CC=C4CC(CCC4(C)C3CCC12C)OC(=O)C(C)Cl
|
|
| MolPort-042-646-606 |
0.76 |
CCCCCCCCC1CCC2C3CC=C4C[C@H](CC[C@]4(C)C3CC[C@]12C)OC(=O)C(C)(C)Br
|
|
| MolPort-002-510-917 |
0.76 |
CCCCCCCCC1CCC2C3CC=C4C[C@H](CC[C@]4(C)C3CC[C@]12C)OC(=O)CCCl
|
|
| MolPort-007-549-248 |
0.76 |
CC(C)CCCC(C)C1CCC2C3CC=C4CC(CCC4(C)C3CCC12C)OC(=O)C(C)Br
|
|
| MolPort-002-511-603 |
0.76 |
C[C@]12CCC3C(CC=C4CC(CC[C@]34C)OC(=O)CCC(O)=O)C1CCC2=O
|
|
| MolPort-006-112-402 |
0.76 |
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](CC1=CC3=O)OC(C)=O
|
|
| MolPort-030-082-248 |
0.76 |
CC(C)CCCC(C)C1CCC2C3CC=C4CC(CCC4(C)C3CCC12C)OC(=O)CCCl
|
|
| MolPort-003-719-575 |
0.76 |
CC(C)CCCC(C)C1CCC2C3CC=C4CC(CCC4(C)C3CCC12C)OC(=O)CC(F)(F)F
|
|
| MolPort-039-139-007 |
0.76 |
CCCCC[C@H](O)\C=C\[C@H]1[C@H]2C[C@H](O)[C@@H]1C\C=C/CCCC(=O)O2
|
|
| MolPort-046-596-253 |
0.75 |
CC(=O)[C@@]1(O)CCC2C3CC=C4CC(CC[C@]4(C)C3CC[C@]12C)OC=O
|
|
| MolPort-046-596-237 |
0.75 |
CC(=O)OC1CC[C@]2(C)C3CC[C@@]4(C)C(CC(C)=C4C(C)=O)C3CC=C2C1
|
|
| MolPort-002-506-971 |
0.75 |
CC(=O)O[C@H]1CC[C@]2(C)[C@H]3CC[C@@]4(C)[C@@H](CC=C4C(C)=O)[C@@H]3CC=C2C1
|
|
| MolPort-046-598-125 |
0.75 |
CCC(=O)C1=CCC2C3CC=C4CC(CC[C@]4(C)C3CC[C@]12C)OC(C)=O
|
|
| MolPort-002-510-540 |
0.75 |
CC(=O)OC1CC[C@]2(C)C3CC[C@@]4(C)C(CC=C4C(C)=O)C3CC=C2C1
|
|
| MolPort-002-528-163 |
0.75 |
CCC(=O)C1=CC[C@H]2[C@@H]3CC=C4C[C@H](CC[C@]4(C)[C@H]3CC[C@]12C)OC(C)=O
|
|
| MolPort-003-892-390 |
0.75 |
CC(=O)OC1CCC2(C)C3CCC4(C)C(CC=C4C(C)=O)C3CC=C2C1
|
|
| MolPort-002-116-802 |
0.75 |
CC(=O)OC1CCC2(C)C3CCC4(C)C(CC(C)=C4C(C)=O)C3CC=C2C1
|
|
| MolPort-002-519-875 |
0.75 |
CC(=O)[C@@]1(O)CCC2[C@@H]3CC=C4C[C@H](CC[C@]4(C)C3CC[C@]12C)OC=O
|
|
| MolPort-002-525-134 |
0.75 |
CC(=O)O[C@H]1CC[C@]2(C)C3CC[C@@]4(C)C(CC(C)=C4C(C)=O)[C@@H]3CC=C2C1
|
|
| MolPort-002-516-283 |
0.75 |
C[C@H]1[C@H]2[C@H](CC3[C@@H]4CC=C5C[C@H](CC[C@]5(C)C4CC[C@]23C)OC(C)=O)O[C@]11CC[C@@H](C)CO1
|
|
| MolPort-001-936-790 |
0.75 |
CC1C2C(CC3C4CC=C5CC(CCC5(C)C4CCC23C)OC(C)=O)OC11CCC(C)CO1
|
|
| MolPort-002-507-219 |
0.75 |
C[C@H]1[C@H]2[C@H](C[C@H]3[C@@H]4CC=C5C[C@@H](CC[C@]5(C)[C@H]4CC[C@]23C)OC(C)=O)O[C@]11CC[C@@H](C)CO1
|
|
| MolPort-002-524-765 |
0.75 |
C[C@H]1[C@H]2[C@H](CC3[C@@H]4CC=C5C[C@@H](CC[C@]5(C)C4CC[C@]23C)OC(C)=O)O[C@]11CC[C@@H](C)CO1
|
|
| MolPort-044-755-259 |
0.75 |
C[C@H]1[C@H]2[C@H](C[C@H]3[C@@H]4CC=C5C[C@H](CC[C@]5(C)[C@H]4CC[C@]23C)OC(C)=O)O[C@]11CC[C@@H](C)CO1
|
|
| MolPort-027-640-929 |
0.75 |
CCCCC[C@H](O)\C=C\[C@H]1C2CC(CO2)[C@@H]1C\C=C\CCCC(O)=O
|
|
| MolPort-019-939-222 |
0.75 |
CCCCC[C@H](O)\C=C\[C@H]1[C@H]2C[C@H](CO2)[C@@H]1C\C=C/CCCC(O)=O
|
|
| MolPort-003-931-083 |
0.75 |
CCCCC[C@H](O)\C=C\[C@H]1C2CC(CO2)[C@@H]1C\C=C/CCCC(O)=O
|
|
| MolPort-044-755-193 |
0.75 |
CC(=O)O[C@H]1CC[C@H]2[C@@H]3CCC4=CCCC[C@]4(C)[C@H]3CC[C@]12C
|
|
| MolPort-035-706-316 |
0.75 |
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-002-509-430 |
0.75 |
CCOC(=O)CC[C@H](C)[C@@H]1CCC2C3CCC4=CC(O)CC[C@]4(C)C3CC[C@]12C
|
|
| MolPort-002-800-510 |
0.75 |
CC(C)(C)OC1CCC2(C)C3CCC4(C)C(O)CCC4C3CC=C2C1
|
|
| MCULE-2386800783 |
0.75 |
O(C1CC2CC1C1C2C2CC1C=C2)C(C)=O
|
|
| MCULE-8723675857 |
0.75 |
[C@]12(C)CCC3[C@@]([H])(CC=C4C[C@@H](OC=O)CC[C@]34C)C1CC[C@]2(O)C(C)=O
|
|
| MCULE-3011305929 |
0.75 |
[C@]12(C)CC[C@]3([C@@]([H])(CC=C4C[C@H](CC[C@]34C)OC(C)=O)[C@]1([H])CC=C2C(C)=O)[H]
|
|
| MCULE-9824449913 |
0.75 |
C12(C)CCC3C(CC=C4CC(CCC34C)OC(C)=O)C1CC(C)=C2C(C)=O
|
|
| MCULE-7465845608 |
0.75 |
C(C)(=O)OC1CCC2(C)C3CCC4(C)C(=CCC4C3CC(C)=C2C1)C(C)=O
|
|
| MCULE-9952649566 |
0.75 |
CC12CCC3([H])C4(CCC(OC(=O)C)CC4=C(C)CC3([H])C1([H])CC(C)=C2C(=O)C)C
|
|
| MCULE-7414624056 |
0.75 |
C12(C)CCC3C(CC=C4CC(CCC34C)OC(C)=O)C1CC=C2C(C)=O
|
|
| MCULE-1496776491 |
0.75 |
[C@]12(C)CC[C@]3([C@@]([H])(CC=C4C[C@H](CC[C@]34C)OC(C)=O)[C@]1([H])CC=C2C(CC)=O)[H]
|
|
| MCULE-7853850848 |
0.75 |
[C@]12(C)CC[C@]3([C@@]([H])(CC=C4C[C@@H](CC[C@]34C)OC(C)=O)[C@]1([H])C[C@H]1[C@@H]2[C@H](C)[C@]2(O1)CC[C@H](CO2)C)[H]
|
|
| MCULE-7620764075 |
0.75 |
C12(C)CCC3C(CC=C4CC(CCC34C)OC(C)=O)C1CC1C2C(C)C2(O1)CCC(CO2)C
|
|
| MCULE-2867849826 |
0.75 |
C12(C)CCC(CC1=CCC1C2CCC2(C1CCC2O)C)OC(C)(C)C
|
|
| MCULE-4320007788 |
0.75 |
C1[C@H]2C[C@H]([C@H](C=C[C@@H](O)CCCCC)[C@H]2CC=CCCCC(O)=O)O1
|
|
| MCULE-1537420527 |
0.75 |
[C@]12(C)CCC3C(CCC4=CC(O)CC[C@]34C)C1CC[C@H]2[C@@H](C)CCC(OCC)=O
|
|
| MCULE-9600703174 |
0.75 |
C(C)(=O)OC1CCC2(C)C3C=CC4(C)C(C(C)CCCOC(C)=O)CCC4C3CCC2(C1)[H]
|
|
| MCULE-8674366228 |
0.75 |
C(C)(=O)OC1CCC2(C)C3C(CC=C2C1)C1CCC(C1CC3)C(OC1C=CC2C3CC(CC3)C12)=O
|
|
| MCULE-5578038643 |
0.75 |
O(C1CCC2C1(C)CCC1C2CC=C2CCCCC21C)C(C)=O
|
|
| MCULE-4161111446 |
0.75 |
CC(=O)O[C@H]1CC[C@@]2([C@]3(CC[C@@]4(C(=O)CC[C@@]4([H])[C@]3([H])C(=O)C=C2C1)C)[H])C
|
|
| MCULE-1885429632 |
0.75 |
[C@]12(C)CCC(CC1=CC(=O)C1C2CC[C@]2(C1CCC2OC(C)=O)C)OC(C)=O
|
|
| MCULE-8156762045 |
0.75 |
[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(CCCCl)=O
|
|
| MCULE-2099620813 |
0.75 |
C1CC2(C)C(=CC(=O)C3C2CCC2(C)C(=O)CCC32)CC1OC(=O)C
|
|
| MCULE-2754196624 |
0.75 |
C12(C)CCC3C(CC=C4CC(CCC34C)OC(=O)CC(C)Cl)C1CCC2C(C)CCCC(C)C
|
|
| MCULE-7719471412 |
0.75 |
[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(=O)CC(C)Cl
|
|
| MCULE-7841141029 |
0.75 |
C12(C)CCC3C(CC=C4CC(CCC34C)OC(CCCCl)=O)C1CCC2C(C)CCCC(C)C
|
|
| MCULE-2735287875 |
0.75 |
C12(C)CCC3C(CC=C4CC(CCC34C)OC(=O)CC(C)Br)C1CCC2C(C)CCCC(C)C
|
|
| MCULE-3530343693 |
0.75 |
C(C)(=O)OC1CCC2(C)C(O)(C1)CC=C1C3CCC(C(C)C=CC(C)C(C)C)C3(C)CC(O)C21
|
|
| MolPort-007-549-252 |
0.75 |
CC(C)CCCC(C)C1CCC2C3CC=C4CC(CCC4(C)C3CCC12C)OC(=O)CC(C)Cl
|
|
| MolPort-002-528-731 |
0.75 |
CCCCCCCC[C@H]1CC[C@H]2[C@@H]3CC=C4C[C@H](CC[C@]4(C)[C@H]3CC[C@]12C)OC(=O)CC(C)Cl
|
|
| MolPort-007-549-280 |
0.75 |
CC(C)CCCC(C)C1CCC2C3CC=C4CC(CCC4(C)C3CCC12C)OC(=O)CC(C)Br
|
|
| MolPort-030-082-249 |
0.75 |
CC(C)CCCC(C)C1CCC2C3CC=C4CC(CCC4(C)C3CCC12C)OC(=O)CCCCl
|
|
| MolPort-046-596-265 |
0.75 |
CCCCCCCCC1CCC2C3CC=C4C[C@H](CC[C@]4(C)C3CC[C@]12C)OC(=O)CCCCl
|
|
| MolPort-002-818-342 |
0.75 |
CC(=O)OC1CCC2C3C(CC[C@]12C)[C@@]1(C)CCC(CC1=CC3=O)OC(C)=O
|
|
| MolPort-046-690-008 |
0.75 |
CC(C)CCC[C@@H](C)[C@H]1CC[C@H]2[C@@H]3CC=C4[C@H](OC(C)=O)[C@@H](O)CC[C@]4(C)[C@H]3CC[C@]12C
|
|
| MolPort-002-525-874 |
0.75 |
C[C@]12CCC3[C@@H](CCC4=C[C@@H](O)CC[C@]34C)C1CC[C@@]21CCC(=O)O1
|
|
| MolPort-035-681-208 |
0.75 |
CC(=O)O[C@H]1CC[C@H]2[C@H]3[C@H](CC[C@]12C)[C@@]1(C)CC[C@@H](CC1=CC3=O)OC(C)=O
|
|
| MolPort-002-530-290 |
0.75 |
CCCCCCCC[C@H]1CC[C@H]2[C@@H]3CC=C4C[C@H](CC[C@]4(C)[C@H]3CC[C@]12C)OC(=O)CCCCl
|
|
| MolPort-046-596-359 |
0.75 |
CCCCCCCCC1CCC2C3CC=C4C[C@H](CC[C@]4(C)C3CC[C@]12C)OC(=O)CC(C)Cl
|
|
| MolPort-046-067-645 |
0.74 |
CC1C=C(C)C2[C@H](C)C1(COC(C)=O)COC21CCCC1
|
|
| MolPort-001-740-441 |
0.74 |
CC(=O)O[C@H]1C[C@@H](O)C(C)(C)C2C[C@@H](OC(C)=O)[C@]3(C)C(CC[C@@]4(C)C(CC=C34)C(CO)CC(O)C3OC3(C)C)[C@@]12C
|
|
| MCULE-9469349565 |
0.74 |
C(C)(=O)OC1CCC2(C)C3CCC4(C)C(CCC4C3CC=C2C1)=C(COC(=O)C)C#N
|
|
| MCULE-5003752801 |
0.74 |
C1CC2C(CC=C3CC(OCCC)CCC23C)C2CCC(C(C)CCCC(C)C)C12C
|
|
| MCULE-7789504566 |
0.74 |
C12(C)CCC3(C([H])(CC=C4CC(OCCCC)CCC34C)C1([H])CCC2([H])C(C)CCCC(C)C)[H]
|
|
| MCULE-1540404527 |
0.74 |
[C@]12(C)CCC3C(CC=C4CC(OCCC)CC[C@]34C)C1CCC2C(C)/C=C/C(CC)C(C)C
|
|
| MCULE-2981823417 |
0.74 |
C1CC2C(CC=C3CC(OCCC(C)C)CCC23C)C2CCC(C(C)CCCC(C)C)C12C
|
|
| MCULE-8031207513 |
0.74 |
C12(C)CCC3C(CC=C4CC(OC(C)=O)CCC43C)C1CC=C2C1(C)OCCO1
|
|
| MCULE-9277315767 |
0.74 |
C12(C)CCC(OC(C)=O)CC1=CCC1C2CCC2(C)C1CCC2=NO
|
|
| MCULE-1369147799 |
0.74 |
C12(C)CCC3C(CC=C4CC(CCC34C)OC(C)=O)C1CCC2C(C)=NO
|
|
| MCULE-3400915813 |
0.74 |
[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(C(CC)Cl)=O
|
|
| MCULE-8587814356 |
0.74 |
[C@]12(C)CC[C@]3([C@@]([H])(CC=C4C[C@H](CC[C@]34C)OC(C)=O)[C@]1([H])CC[C@]2(O)C(=O)COC(C)=O)[H]
|
|
| MCULE-4793681995 |
0.74 |
C12(C)CCC3C(CC=C4CC(CCC34C)OC(C)=O)C1CCC2(O)C(=O)COC(C)=O
|
|
| MCULE-5897713249 |
0.74 |
C(CBr)(=O)OC1CCC2(C)C3CCC4(C)C(CCC4C3CC=C2C1)=O
|
|
| MCULE-2146538095 |
0.74 |
C12(C)CCC3C(CC=C4CC(CCC34C)OC(=O)C(C(C)C)Cl)C1CCC2C(C)CCCC(C)C
|
|
| MCULE-1159937489 |
0.74 |
C(CCl)(=O)OC1CCC2(C)C3CCC4(C)C(CCC4C3CC=C2C1)=O
|
|
| MCULE-6078616811 |
0.74 |
C12(C)CCC3C(CC=C4CC(CCC34C)OC(C)=O)C1CC(Cl)C2C(C)=O
|
|
| MCULE-2971649214 |
0.74 |
CC(OC1CC2C(C3C(CC=2)C2CC4C(C(=O)C)(C2(C)CC3)O4)(C)CC1)=O
|
|
| MCULE-4355449378 |
0.74 |
[C@]12(C)CC[C@@H](CC1=CCC1C2CC[C@]2(C1CCC2CCCCCCCC)C)OC(C(CC)Br)=O
|
|
| MCULE-8270116982 |
0.74 |
C12(C)CCC3C(CC=C4CC(CCC34C)OC(C(CC)Cl)=O)C1CCC2C(C)CCCC(C)C
|
|
| MCULE-3933385900 |
0.74 |
[C@]12(C(C)=O)[C@H](O1)CC1[C@]3(C(CC[C@]21C)[C@@]1(C)CC[C@@H](CC1=CC3)OC(C)=O)[H]
|
|
| MCULE-5547837860 |
0.74 |
C12(C)CCC3C(CC=C4CC(CCC34C)OC(=O)C(C(C)C)Br)C1CCC2C(C)CCCC(C)C
|
|
| MCULE-1802116837 |
0.74 |
CC(OC1CC2C(C)(C3C(CC=2)C2CC=C(I)C2(C)CC3)CC1)=O
|
|
| MCULE-7025667843 |
0.74 |
C12(C)CCC(CC1=CCC1C2CCC2(C1CCC2CCCCCCCC)C)OC(=O)C(C(C)C)Cl
|
|
| MCULE-2016791403 |
0.74 |
C(O[C@H]1CC[C@]2(C)[C@@]3([H])CC[C@]4(C)[C@@]5(C(C)=O)[C@@]([H])(C[C@@]4([H])[C@]3([H])CC=C2C1)O5)(=O)C
|
|
| MCULE-6896548973 |
0.74 |
C12(C)CCC3C(CC=C4CC(CCC34C)OC(C(CC)Br)=O)C1CCC2C(C)CCCC(C)C
|
|
| MCULE-1659038217 |
0.74 |
[C@]12(C)CCC3C(CC=C4C[C@H](CC[C@]34C)OC(=O)C(C(C)C)Br)C1CC[C@]2([H])[C@H](C)CCCC(C)C
|
|
| MCULE-1488736836 |
0.74 |
C12(C)CCC3C(CC=C4CC(CCC34C)OC(C)=O)C1CC(C(C#N)C#N)C2C(C)=O
|
|
| MCULE-4712498553 |
0.74 |
C12(C)CCC(CC1=CCC1C2CCC2(C1CCC2CCCCCCCC)C)OC(C(CC)Br)=O
|
|
| MCULE-2095449953 |
0.74 |
C12(C(C)=O)CC3C(C)(CCC4C3CC=C3C4(C)CCC(C3)OC(C)=O)C1O2
|
|
| MCULE-7142425021 |
0.74 |
[C@]12(C)CCC3C(CC=C4CC(CC[C@]34C)OC(C)=O)C1CC(Cl)C2C(C)=O
|
|
| MCULE-1172054424 |
0.74 |
[C@@]12(C(C)=O)CC3C(C)(CCC4C3CC=C3C4(C)CCC(C3)OC(C)=O)[C@@H]1O2
|
|
| MCULE-3696298012 |
0.74 |
O=C(C(F)(F)F)OC1CCC2(C)C3CCC4(C)C(CCC4C3CC=C2C1)=O
|
|
| MCULE-8383342390 |
0.74 |
CC(CCCC(C1C2(C)C(C3C(CC2)C2(C)C(CC(OC(COCC(OC4CC5C(C6C(CC=5)C5C(C(C(CCCC(C)C)C)CC5)(C)CC6)(C)CC4)=O)=O)CC2)=CC3)CC1)C)C
|
|
| MCULE-7508700654 |
0.74 |
[C@]12(C)CCC3[C@@]([H])(CC=C4C[C@H](CC[C@]34C)OC(C)=O)C1C[C@@H](C)[C@]2(OO)C(C)=O
|
|
| MCULE-9088951308 |
0.74 |
[C@]12(C)CC[C@@H](CC1=CCC1C2CC[C@]2(C1CCC2CCCCCCCC)C)OC(=O)C(C(C)C)Cl
|
|
| MolPort-044-649-750 |
0.74 |
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)(COC(C)=O)C=C5COC(C)=O)[C@@H]2[C@H]1C)C(O)=O
|
|
| MolPort-006-114-296 |
0.74 |
CC(C)[C@@H](C)\C=C\[C@@H](C)[C@H]1CC[C@H]2C3=CC=C4C[C@H](CC[C@]4(C)[C@H]3CC[C@]12C)OC(C)=O
|
|
| MolPort-044-755-237 |
0.74 |
CC(C)CCC[C@@H](C)[C@H]1CC[C@H]2[C@@H]3C[C@@H](O)[C@]4(C)C[C@H](CCC4=C3CC[C@]12C)OC(C)=O
|
|
| MolPort-035-706-399 |
0.74 |
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-007-980-828 |
0.74 |
CC(=O)OC1CCC2(C)C3CCC4(C)[C@@H]5O[C@@]5(CC4C3CC=C2C1)C(C)=O
|
|
| MolPort-002-529-653 |
0.74 |
CCCCCCCC[C@H]1CC[C@H]2[C@@H]3CC=C4C[C@H](CC[C@]4(C)[C@H]3CC[C@]12C)OC(=O)C(Cl)CC
|
|
| MolPort-002-526-404 |
0.74 |
CC(=O)O[C@H]1CC[C@]2(C)C3CC[C@@]4(C)C(C[C@H]5O[C@@]45C(C)=O)[C@@H]3CC=C2C1
|
|
| MolPort-005-909-126 |
0.74 |
CC(C)CCCC(C)C1CCC2C3CC=C4CC(CCC4(C)C3CCC12C)OC(=O)COCC(=O)OC1CCC2(C)C3CCC4(C)C(CCC4C3CC=C2C1)C(C)CCCC(C)C
|
|
| MolPort-003-855-536 |
0.74 |
CCCCCCCCC1CCC2C3CC=C4CC(CCC4(C)C3CCC12C)OC(=O)C(Br)CC
|
|
| MolPort-000-480-271 |
0.74 |
CC(=O)OC1CCC2(C)C3CCC4(C)C(CCC4\C(C)=N\O)C3CC=C2C1
|
|
| MolPort-007-549-253 |
0.74 |
CC(C)CCCC(C)C1CCC2C3CC=C4CC(CCC4(C)C3CCC12C)OC(=O)C(Br)C(C)C
|
|
| MolPort-002-526-047 |
0.74 |
C[C@@H]1CC2[C@@H]3CC=C4C[C@H](CC[C@]4(C)C3CC[C@]2(C)[C@@]1(OO)C(C)=O)OC(C)=O
|
|
| MolPort-000-835-526 |
0.74 |
CC(=O)OCC(=O)C1(O)CCC2C3CC=C4CC(CCC4(C)C3CCC12C)OC(C)=O
|
|
| MolPort-009-649-149 |
0.74 |
CC(C)CCC[C@@H](C)[C@H]1CCC2C3CC=C4C[C@H](CC[C@]4(C)C3CC[C@]12C)OC(=O)C(Br)C(C)C
|
|
| MolPort-002-528-954 |
0.74 |
CC(=O)OCC(=O)[C@@]1(O)CC[C@H]2[C@@H]3CC=C4C[C@H](CC[C@]4(C)[C@H]3CC[C@]12C)OC(C)=O
|
|
| MolPort-007-549-251 |
0.74 |
CCC(Cl)C(=O)OC1CCC2(C)C3CCC4(C)C(CCC4C3CC=C2C1)C(C)CCCC(C)C
|
|
| MolPort-007-549-282 |
0.74 |
CC(C)CCCC(C)C1CCC2C3CC=C4CC(CCC4(C)C3CCC12C)OC(=O)C(Cl)C(C)C
|
|
| MolPort-046-597-639 |
0.74 |
CC(C)CCCC(C)C1CCC2C3CC=C4C[C@H](CC[C@]4(C)C3CC[C@]12C)OC(=O)C(Br)C(C)C
|
|
| MolPort-027-948-624 |
0.74 |
CC(=O)O[C@H]1CC[C@]2(C)[C@H]3CC[C@@]4(C)[C@@H](CC5O[C@@]45C(C)=O)[C@@H]3CC=C2C1
|
|
| MolPort-002-509-437 |
0.74 |
CC(=O)OC1CC[C@]2(C)C3CC[C@@]4(C)C(CC(Cl)C4C(C)=O)C3CC=C2C1
|
|
| MolPort-002-509-617 |
0.74 |
CCCCCCCCC1CCC2C3CC=C4C[C@H](CC[C@]4(C)C3CC[C@]12C)OC(=O)C(Br)CC
|
|
| MolPort-007-549-279 |
0.74 |
CCC(Br)C(=O)OC1CCC2(C)C3CCC4(C)C(CCC4C3CC=C2C1)C(C)CCCC(C)C
|
|
| MolPort-010-969-193 |
0.74 |
CC(=O)OC1CCC2(C)C3CCC4(C)C(CC5OC45C(C)=O)C3CC=C2C1
|
|
| MolPort-046-594-619 |
0.74 |
CCCCCCCCC1CCC2C3CC=C4CC(CCC4(C)C3CCC12C)OC(=O)C(Cl)C(C)C
|
|
| MolPort-046-596-304 |
0.74 |
CCCCCCCCC1CCC2C3CC=C4C[C@H](CC[C@]4(C)C3CC[C@]12C)OC(=O)C(Cl)CC
|
|
| MolPort-046-596-317 |
0.74 |
C[C@@H]1CC2C3CC=C4CC(CC[C@]4(C)C3CC[C@]2(C)[C@@]1(OO)C(C)=O)OC(C)=O
|
|
| MolPort-006-126-876 |
0.74 |
CC(=O)O[C@H]1CC[C@]2(C)[C@H]3CC[C@@]4(C)[C@@H](C[C@H]5O[C@@]45C(C)=O)[C@@H]3CC=C2C1
|
|
| MolPort-046-596-357 |
0.74 |
CC(=O)OC1CC[C@]2(C)C3CC[C@]4(C)[C@@H]5O[C@@]5(CC4C3CC=C2C1)C(C)=O
|
|
| MolPort-002-151-053 |
0.74 |
CC(=O)OC1CCC2(C)C3CCC4(C)C(CCC4C(C)=NO)C3CC=C2C1
|
|
| MolPort-002-510-984 |
0.74 |
CCCCCCCCC1CCC2C3CC=C4C[C@H](CC[C@]4(C)C3CC[C@]12C)OC(=O)C(Cl)C(C)C
|
|
| MolPort-046-596-337 |
0.74 |
CC(=O)OCC(=O)[C@@]1(O)CCC2C3CC=C4CC(CC[C@]4(C)C3CC[C@]12C)OC(C)=O
|
|
| MolPort-046-596-236 |
0.73 |
CC(=O)O[C@@]1(CCC2C3CCC4=CC(O)CC[C@]4(C)C3CC[C@]12C)C(C)=O
|
|
| MolPort-002-527-421 |
0.73 |
CC(=O)O[C@@]1(CCC2[C@@H]3CCC4=C[C@@H](O)CC[C@]4(C)C3CC[C@]12C)C(C)=O
|
|
| MolPort-002-800-509 |
0.73 |
CC(C)(C)OC1CCC2(C)C3CCC4(C)C(CCC4=O)C3CC=C2C1
|
|
| MolPort-030-065-228 |
0.73 |
CCCC(=O)OC1CC[C@]2(C)C3CC[C@@]4(C)C(CC5OC6(CCC(C)CO6)C(C)C45)C3CC=C2C1
|
|
| MolPort-002-527-555 |
0.73 |
CCCC(=O)O[C@@H]1CC[C@]2(C)[C@H]3CC[C@@]4(C)[C@@H](C[C@@H]5O[C@]6(CC[C@@H](C)CO6)[C@@H](C)[C@H]45)[C@@H]3CC=C2C1
|
|
| MolPort-046-158-505 |
0.73 |
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-020-005-732 |
0.73 |
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-035-706-459 |
0.73 |
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-035-706-384 |
0.73 |
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 |
0.73 |
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-046-762-538 |
0.73 |
CC(=O)O[C@H]1CC[C@]2(C)[C@@H]3CC[C@@]4(C)[C@H](C=CC4=O)[C@@H]3CC=C2C1
|
|
| MolPort-000-706-450 |
0.73 |
CC(=O)OC1CCC2(C)C3CCC4(C)C(CC=C4C#N)C3CC=C2C1
|
|
| MolPort-002-520-554 |
0.73 |
CC(=O)OC1CC[C@]2(C)[C@H]3CC[C@@]4(C)[C@@H](CC=C4C#N)[C@@H]3CC=C2C1
|
|
| MolPort-002-507-134 |
0.73 |
CC(=O)O[C@H]1CC[C@]2(C)C3CC[C@@]4(C)[C@@H](CC=C4C#N)[C@@H]3CC=C2C1
|
|
| MCULE-1292912968 |
0.73 |
[C@]12(C)CCC3[C@@]([H])(CCC4=C[C@@H](O)CC[C@]34C)C1CC[C@@]2(C(C)=O)OC(C)=O
|
|
| MCULE-7872068756 |
0.73 |
[C@]12(C)CC[C@]3([C@@]([H])(CC=C4C[C@@H](CC[C@]34C)OC(CCC)=O)[C@]1([H])C[C@H]1[C@]2([H])[C@H](C)[C@]2(O1)CC[C@H](CO2)C)[H]
|
|
| MCULE-6934635209 |
0.73 |
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-8789756191 |
0.73 |
C12(C)C(=CCC)CCC1C1C(CC2)C2(C)CCC(CC2CC1)OC(C)=O
|
|
| MCULE-6651693585 |
0.73 |
O=C1CCC2(COC(C)=O)C3CCC4(C)C(CCC4C3CCC2=C1)C(O)=O
|
|
| MCULE-4509171836 |
0.73 |
C12(C)CCC(CC1=CCC1C2CCC2(C1CC=C2C#N)C)OC(C)=O
|
|
| MCULE-1491500449 |
0.73 |
O1C(CC2C1C1(C)C(C2)C2C(CC1)C1(C)CCC(O)CC1=CC2)=O
|
|
| MCULE-9075211166 |
0.73 |
[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 |
0.73 |
CC12C3(OC(=O)CC3)CCC1C1CC=C3C(C)(C1CC2)CCC(O)C3
|
|
| MCULE-1911874268 |
0.73 |
C12CC(OCC=C)CCC1(C)C1CCC3(C)CCCC3C1CC=2
|
|
| MCULE-3228172357 |
0.73 |
C12(C)CCC3C(CC=C4CC(CCC34C)OC(C)=O)C1CC1OC(CCC(C)COC(C)=O)=C(C)C21
|
|
| MCULE-8750715978 |
0.73 |
C12(COCC(C(C)=CC1C)C2C)COC(C)=O
|
|
| MCULE-5380330078 |
0.73 |
C12(COC(C)=O)COC(C(C(C)=CC1C)C2)C
|
|
| MCULE-3464870838 |
0.73 |
C12(COC(C)=O)CC=C(C(C(C)OC1)C2C)C
|
|
| MCULE-5167148308 |
0.73 |
C12(COC(C)=O)COC(C(C(C)=CC1C)C2)CC
|
|
| MCULE-1871622668 |
0.73 |
CC(=C)C(=O)OC1CC2CC1C=C2
|
|
| MCULE-8928558825 |
0.73 |
C12C(C)OCC(COC(C)=O)(CC=C1C)C2
|
|
| MCULE-3656083222 |
0.73 |
C12(COC(C)=O)COC(C(C(C)=CC1C)C2C)C
|
|
| MCULE-9403520396 |
0.73 |
C12(COC(C)=O)COC(C(C(C)=CC1C)C2C)CC
|
|
| MolPort-035-946-559 |
0.73 |
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 |
0.73 |
CC12CCC3C(CC=C4CC(O)CCC34C)C1CCC21CCC(=O)O1
|
|
| MolPort-000-208-022 |
0.73 |
CC1(CCC(=O)O1)C1CCC2C3CC=C4C[C@@H](O)CC[C@]4(C)C3CC[C@]12C
|
|
| MolPort-005-944-076 |
0.73 |
CC(C)C(=C)CCC(C)[C@H]1CC=C2C3=C([C@@H](O)[C@H](OC(C)=O)[C@]12C)[C@@]1(C)C[C@@H](O)[C@H](O)C(C)(C)C1CC3
|
|
| MolPort-002-510-346 |
0.73 |
CC(CCC1=C(C)C2C(CC3C4CC=C5CC(CC[C@]5(C)C4CC[C@]23C)OC(C)=O)O1)COC(C)=O
|
|
| MolPort-000-716-448 |
0.73 |
CC(CCC1=C(C)C2C(CC3C4CC=C5CC(CCC5(C)C4CCC23C)OC(C)=O)O1)COC(C)=O
|
|
| MolPort-001-917-582 |
0.73 |
CC1OCC2(COC(C)=O)C(C)C=C(C)C1C2C
|
|
| MolPort-002-511-748 |
0.73 |
CCC1OC[C@]2(COC(C)=O)C(C)C=C(C)[C@H]1C2C
|
|
| MolPort-045-967-846 |
0.73 |
CC1OCC2(COC(C)=O)CC=C(C)C1C2
|
|
| MolPort-045-968-438 |
0.73 |
CCC1OCC2(COC(C)=O)C(C)C=C(C)C1C2C
|
|
| MolPort-001-917-581 |
0.73 |
CC1OCC2(COC(C)=O)CC1C(C)=CC2C
|
|
| MolPort-045-901-429 |
0.73 |
CCC1OCC2(COC(C)=O)CC1C(C)=CC2C
|
|
| MolPort-002-509-111 |
0.73 |
CC1OCC2(COC(C)=O)C(C)C=C(C)C1[C@H]2C
|
|
| MolPort-000-719-806 |
0.73 |
CC1OCC2(COC(C)=O)CC=C(C)C1C2C
|
|
| MolPort-002-508-786 |
0.73 |
CCCCC1OC[C@]2(COC(C)=O)C(C)C=C(C)[C@@H]1C2C
|
|
| MolPort-000-730-174 |
0.73 |
CC(C)C1OCC2(COC(C)=O)CC=C(C)C1C2
|
|
| MolPort-002-511-574 |
0.73 |
CC1OC[C@]2(COC(C)=O)CC=C(C)[C@H]1C2C
|
|
| MolPort-042-923-465 |
0.73 |
CC(=C)C(=O)OC1CC2CC1C=C2
|
|
| MolPort-002-511-738 |
0.73 |
CC1C=C(C)[C@@H]2COC[C@@]1(COC(C)=O)C2C
|
|
| MolPort-046-067-698 |
0.73 |
CCCCCC1OCC2(COC(C)=O)C(C)C=C(C)C1[C@@H]2C
|
|
| MolPort-002-510-237 |
0.73 |
CC1OC[C@]2(COC(C)=O)CC=C(C)[C@H]1C2
|
|
| MolPort-002-529-274 |
0.73 |
CC1OCC2(COC(C)=O)CC=C(C)C1[C@H]2C
|
|
| MolPort-002-513-437 |
0.73 |
CC(C)C1OCC2(COC(C)=O)C(C)C=C(C)C1[C@H]2C
|
|
| MolPort-002-510-168 |
0.73 |
CCC1OC[C@]2(COC(C)=O)C[C@H]1C(C)=CC2C
|
|
| MolPort-002-510-314 |
0.73 |
CC(C)C1OC[C@@]2(COC(C)=O)CC=C(C)[C@@H]1C2
|
|
| MolPort-046-761-006 |
0.73 |
CCCCCCCCCCCCCCCC(=O)O[C@H]1CC[C@@]2(C)[C@@H](CC[C@]3(C)[C@@H]2[C@@H]2O[C@@H]2[C@@]2(C)[C@@H]4CC(C)(C)CC[C@]4(C)CC=C32)C1(C)C
|
|
| MolPort-002-131-793 |
0.73 |
CC1C=C(C)C2COCC1(COC(C)=O)C2C
|
|
| MolPort-008-346-776 |
0.73 |
CC1OC[C@@]2(COC(C)=O)C[C@@H]1C(C)=CC2C
|
|
| MolPort-002-511-630 |
0.73 |
CCCCCCC1OC[C@]2(COC(C)=O)C(C)C=C(C)[C@H]1C2C
|
|
| MolPort-002-510-241 |
0.72 |
CC(=O)OCC(=O)[C@]1(CCC2C3CC=C4CC(CC[C@]4(C)C3CC[C@]12C)OC(C)=O)OC(C)=O
|
|
| MolPort-044-755-196 |
0.72 |
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-027-640-913 |
0.72 |
CCCCC[C@H](O)\C=C\[C@H]1[C@H](O)C[C@H](O)[C@@H]1C\C=C/CCCC(=O)OC(C)C
|
|
| MolPort-044-562-012 |
0.72 |
CCCCC[C@](C)(O)\C=C\[C@H]1[C@H](O)C[C@H](O)[C@@H]1C\C=C/CCCC(=O)OC(C)C
|
|
| MolPort-009-649-073 |
0.72 |
CC(C)CCC[C@@H](C)[C@H]1CCC2C3CC=C4C[C@H](CC[C@]4(C)C3CC[C@]12C)OC(=O)\C=C(/C)Cl
|
|
| MolPort-042-646-607 |
0.72 |
CC(C)CCCC(C)C1CCC2C3CC=C4C[C@H](CC[C@]4(C)C3CC[C@]12C)OC(=O)\C=C(/C)Cl
|
|
| MolPort-039-338-837 |
0.72 |
C[C@H](CC\C=C(/C)C(O)=O)[C@H]1C[C@H](OC(C)=O)[C@@]2(C)C3=CCC4C(C)(C)C(=O)CC[C@]4(C)C3=CC[C@]12C
|
|
| MCULE-4160347351 |
0.72 |
[C@]12(C)CCC3C(CC=C4CC(CC[C@]34C)OC(C)=O)C1CC[C@]2(OC(C)=O)C(=O)COC(C)=O
|
|
| MCULE-6635928611 |
0.72 |
C(C)(=O)OC1CCC2(C)C3CCC4(C)C(CC(OC)=O)(CCC4C3CC=C2C1)OC(C)=O
|
|
| MCULE-9629198289 |
0.72 |
CC(C=C(CC1OCCC1)C)O
|
|
| MCULE-9891857644 |
0.72 |
C(C)(=O)OC1CCC2(C)C(O)(C1)CC=C1C3CCC(C(C)C=CC(C)C(C)C)C3(C)CC3C21O3
|
|
| MCULE-3762294950 |
0.72 |
[C@]12(C)CCC3C(CC=C4C[C@H](CC[C@]34C)OC(=O)C=C(C)Cl)C1CCC2C(C)CCCC(C)C
|
|
| MCULE-4587387143 |
0.72 |
C1(C)[C@]2([H])[C@@]3([H])OC(=O)C(=C)[C@]3([H])CCC(C)=C2CC1
|
|
| MCULE-4103920893 |
0.72 |
C12C3C(C4(C)C(CC3)CC(OC(C)=O)CC4)CCC=1C(CC2)(C)C
|
|
| MCULE-1099676593 |
0.72 |
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)Cl)=CC3)[H])([H])CC1)C)C
|
|
| MCULE-9512042267 |
0.72 |
C12(C)CCC3C(CC=C4CC(O)CCC34C)C1CCC2C(=O)COC(C)=O
|
|
| MCULE-5759900991 |
0.72 |
ClC(=O)OC1CCC2(C)C3CCC4(C)C(C(C)C=CC(CC)C(C)C)CCC4C3CC=C2C1
|
|
| MCULE-5047458422 |
0.72 |
C12(C)CCC3(C([H])(CC=C4CC(CCC34C)OC(=O)Cl)C1([H])CCC2([H])C(C)CCCC(C)C)[H]
|
|
| MCULE-5304480316 |
0.72 |
[C@]12(C)CCC3C(CC=C4CC(CC[C@]34C)OC(CC)=O)C1CC1OC(CCC(C)COC(CC)=O)=C(C)C21
|
|
| MCULE-7472025598 |
0.72 |
C12(C(CCOC)=O)C(O1)CC1C3C(CCC21C)C1(C)CCC(CC1=CC3)OC(C)=O
|
|
| MCULE-6259050360 |
0.72 |
[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-9395429387 |
0.72 |
C1C(O)C2(C(C3C(CC2)C(C)C(=O)O3)C(C)=C1)C
|
|
| MCULE-4464120365 |
0.72 |
C(C)(=O)OC1CCC2(C)C3CC(C4(C)C(=CCC4C3CCC2(C1)[H])C(C)=O)OC(C)=O
|
|
| MCULE-7536268908 |
0.72 |
C12(COC(CC)=O)COC(C(C(C)=CC1C)C2)C
|
|
| MolPort-002-810-764 |
0.72 |
CC(=O)OCC(=O)[C@H]1CCC2C3CC=C4C[C@@H](O)CC[C@]4(C)C3CC[C@]12C
|
|
| MolPort-046-762-520 |
0.72 |
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-000-691-653 |
0.72 |
CC(=O)OCC(=O)C1CCC2C3CC=C4CC(O)CCC4(C)C3CCC12C
|
|
| MolPort-003-928-856 |
0.72 |
CC(C)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(Cl)=O
|
|
| MolPort-002-526-754 |
0.72 |
CC(=O)OCC(=O)[C@H]1CCC2[C@@H]3CC=C4C[C@@H](O)CC[C@]4(C)C3CC[C@]12C
|
|
| MolPort-002-512-263 |
0.72 |
CCC(=O)OCC(C)CCC1=C(C)C2C(CC3C4CC=C5CC(CC[C@]5(C)C4CC[C@]23C)OC(=O)CC)O1
|
|
| MolPort-046-158-543 |
0.72 |
CC1(C)CCC[C@]2(C)[C@H]3COC(=O)C3=CC[C@@H]12
|
|
| MolPort-008-346-698 |
0.72 |
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-001-742-285 |
0.72 |
CC1C2CCC3(C)C(O)CC=C(C)C3C2OC1=O
|
|
| MolPort-002-508-440 |
0.72 |
CCC(=O)OC[C@@]12COC(C)[C@@H](C1)C(C)=CC2C
|
|
| MolPort-001-915-776 |
0.72 |
CCC(=O)OCC12COC(C)C(C1)C(C)=CC2C
|
|
| MolPort-001-740-880 |
0.71 |
COC(=O)[C@]1(C)CC[C@H](OC(C)=O)[C@@]2(C)C1C[C@@H](OC(C)=O)C1=C2CC[C@](C)(C=C)[C@@H]1OC(C)=O
|
|
| MolPort-046-597-789 |
0.71 |
CCCC(Br)C(=O)O[C@H]1CC[C@]2(C)C3CC[C@]4(C)C(CCC4C3CC=C2C1)C(C)CCCC(C)C
|
|
| MolPort-007-549-254 |
0.71 |
CCCC(Br)C(=O)OC1CCC2(C)C3CCC4(C)C(CCC4C3CC=C2C1)C(C)CCCC(C)C
|
|
| MolPort-002-509-096 |
0.71 |
CCCCCCCCC1CCC2C3CC=C4C[C@H](CC[C@]4(C)C3CC[C@]12C)OC(=O)C(Cl)CCC
|
|
| MolPort-046-761-029 |
0.71 |
C[C@H](O)[C@@H](C)C(=O)O[C@H]1CC(C)=C2[C@H](C[C@]3(C)CC[C@H](OC(C)=O)C(=C)[C@H]3[C@H](OC(C)=O)[C@H]1C2(C)C)OC(C)=O
|
|
| MolPort-009-649-085 |
0.71 |
CCCC(Br)C(=O)O[C@H]1CC[C@]2(C)C3CC[C@]4(C)[C@H](CCC4C3CC=C2C1)[C@H](C)CCCC(C)C
|
|
| MolPort-007-549-255 |
0.71 |
CCCC(Cl)C(=O)OC1CCC2(C)C3CCC4(C)C(CCC4C3CC=C2C1)C(C)CCCC(C)C
|
|
| MolPort-002-512-229 |
0.71 |
CCCCCC(=O)OC1CC[C@]2(C)C3CC[C@@]4(C)C(CC5O[C@]6(CCC(C)CO6)[C@@H](C)C45)C3CC=C2C1
|
|
| MolPort-001-739-897 |
0.71 |
CC1C(=O)OC[C@H]2C(=C[C@@H]3CC(C)(C)C[C@]123)C(O)=O
|
|
| MolPort-002-507-344 |
0.71 |
CCCCCC(=O)O[C@H]1CC[C@]2(C)[C@H]3CC[C@@]4(C)[C@@H](C[C@@H]5O[C@]6(CC[C@@H](C)CO6)[C@@H](C)[C@H]45)[C@@H]3CC=C2C1
|
|
| MolPort-039-009-490 |
0.71 |
CCCCCC(=O)OC1CCC2(C)C3CCC4(C)C(CC5OC6(CCC(C)CO6)C(C)C45)C3CC=C2C1
|
|
| MolPort-042-665-694 |
0.71 |
CCCCCC(=O)O[C@H]1CC[C@]2(C)C3CC[C@@]4(C)C(CC5OC6(CC[C@@H](C)CO6)C(C)C45)C3CC=C2C1
|
|
| MolPort-019-939-277 |
0.71 |
CCCCCC(=O)O[C@H]1CC[C@]2(C)C3CC[C@@]4(C)C(CC5OC6(CC[C@@H](C)CO6)[C@@H](C)C45)C3CC=C2C1
|
|
| MolPort-002-529-126 |
0.71 |
CCC(=O)OC1C[C@@H]2C[C@H]1C1CC=CC21
|
|
| MolPort-046-418-946 |
0.71 |
CCC(=O)O[C@H]1CC[C@H]2[C@@H]3CCC4=C[C@H](CC[C@]4(C)[C@H]3CC[C@]12C)OC(=O)CC
|
|
| MolPort-009-019-637 |
0.71 |
CCCCC[C@H](O)\C=C\[C@H]1[C@H](O)CC(=O)[C@@H]1C\C=C/CCCC(=O)OC(C)C
|
|
| MolPort-027-640-876 |
0.71 |
CCCCC[C@H](O)\C=C\[C@H]1[C@H](O)CC(=O)[C@H]1C\C=C/CCCC(=O)OC(C)C
|
|
| MolPort-006-122-262 |
0.71 |
CCC(=O)OC1CC2CC1C1CC=CC21
|
|
| MolPort-002-507-829 |
0.71 |
CCC(=O)OC1C[C@@H]2C[C@H]1[C@H]1CC=C[C@@H]21
|
|
| MolPort-002-520-429 |
0.71 |
CCOC(=O)C(\C#N)=C1/CC[C@H]2[C@@H]3CC=C4CC(CC[C@]4(C)[C@H]3CC[C@]12C)OC(C)=O
|
|
| MolPort-002-507-135 |
0.71 |
CCOC(=O)C(\C#N)=C1/CC[C@H]2[C@@H]3CC=C4C[C@H](CC[C@]4(C)[C@H]3CC[C@]12C)OC(C)=O
|
|
| MolPort-030-040-914 |
0.71 |
CCOC(=O)C(\C#N)=C1/CCC2C3CC=C4CC(CCC4(C)C3CCC12C)OC(C)=O
|
|
| MolPort-021-804-541 |
0.71 |
CC(=O)OC1C(O)C=C(C)C2CC3C(CC12C)OC(=O)C3=C
|
|
| MolPort-000-834-002 |
0.71 |
CCOC(=O)C(\C#N)=C1\CCC2C3CC=C4CC(CC[C@]4(C)C3CC[C@]12C)OC(C)=O
|
|
| MCULE-5801016152 |
0.71 |
C12(C)CCC3C(CC=C4CC(CCC34C)OC(C(CCC)Cl)=O)C1CCC2C(C)CCCC(C)C
|
|
| MCULE-5832467090 |
0.71 |
C(C1C=CC=CC=1)(=O)OC1CCC2(C)C3CCC4(C)C(C(C)CCCC(C)C)CCC4C3C(O)(C)C=C2C1
|
|
| MCULE-7514955649 |
0.71 |
C(C)(=O)OC1CCC2(C)C3CCC4(C)CCCC4C3CC(=C2C1)F
|
|
| MCULE-4437204352 |
0.71 |
O(C(=O)C)[C@H]1[C@](C=C)(C)CCC2=C1[C@H](OC(=O)C)CC1[C@]2(C)[C@@H](OC(C)=O)CC[C@@]1(C)C(OC)=O
|
|
| MCULE-4091243013 |
0.71 |
C12(C)CCC3C(CC=C4CC(CCC34C)OC(C(CCC)Br)=O)C1CCC2C(C)CCCC(C)C
|
|
| MCULE-1278548612 |
0.71 |
C12[C@H](OC(C)=O)C[C@@]3([C@](C)([C@H](CC[C@@]3(C)C(OC)=O)OC(C)=O)C=1CC[C@](C)(C=C)[C@@H]2OC(C)=O)[H]
|
|
| MCULE-1838275290 |
0.71 |
[C@]12(C)CC[C@@H](CC1=CCC1C2CC[C@]2(C1CCC2CCCCCCCC)C)OC(C(CCC)Cl)=O
|
|
| MCULE-1637424025 |
0.71 |
C12(C)CCC3C(CC=C4CC(CCC34C)OC(CCCCC)=O)C1CC1C2C(C)C2(O1)CCC(CO2)C
|
|
| MCULE-6852340934 |
0.71 |
[C@]12(C)CC[C@]3([C@@]([H])(CC=C4C[C@H](CC[C@]34C)OC(CCCCC)=O)[C@]1([H])C[C@H]1[C@@H]2[C@H](C)[C@]2(O1)CC[C@H](CO2)C)[H]
|
|
| MCULE-5173677772 |
0.71 |
[C@@H]12C[C@@H](CC1OC(CC)=O)[C@]1([H])C=CC[C@]21[H]
|
|
| MCULE-3213917419 |
0.71 |
C(C)(=O)OC1CCC2(C)C(C1)(CC1C3(C4CCC(C(C)C=CC(C)C(C)C)C4(C)CCC23)O1)[H]
|
|
| MCULE-9005119173 |
0.71 |
C1CC23C([H])(COC(=O)C)C2(CC=CC3)CC1
|
|
| MCULE-2306367523 |
0.71 |
C12CC(CC1OC(CC)=O)C1C=CCC21
|
|
| MCULE-2130027368 |
0.71 |
C1(CCC2C3C(CCC12C)C1(C)CCC(CC1=CC3)OC(C)=O)=C(C#N)C(OCC)=O
|
|
| MCULE-3365689266 |
0.71 |
C1(CCC2C3C(CC[C@]12C)[C@@]1(C)CCC(CC1=CC3)OC(C)=O)=C(C#N)C(OCC)=O
|
|
| MCULE-7441378184 |
0.71 |
C1(CC[C@@]2([H])[C@]3([C@]([H])(CC[C@]12C)[C@@]1(C)CC[C@@H](CC1=CC3)OC(C)=O)[H])=C(C#N)C(OCC)=O
|
|
| MCULE-1726017976 |
0.71 |
C1C(C2(C3CCC4(C(C3(C)C(OC(=O)C)CC2C(C1O)(C)C)=CCC4C1COC(C(C)(O)C)C(O)C1)C)C)OC(=O)C
|
|
| MCULE-6390957697 |
0.71 |
[C@]12(C)CCC3C(CC=C4CC(CC[C@]34C)OC(C)=O)C1CC=C2C(=O)COC(C)=O
|
|
| MCULE-6697936504 |
0.71 |
C1CC2(C)C3C(=O)CC4(C)C(C5(C)CCC(=O)O5)CC(O)C4(C)C=3C(O)CC2C(C)(C)C1=O
|
|
| MCULE-2992568144 |
0.71 |
C12(C)CCC3C(CC=C4CC(CCC34C)OC(C)=O)C1C[C@@H](O)[C@]2(O)C(=O)COC(C)=O
|
|
| MCULE-9714807593 |
0.71 |
C(C)(=O)OC1CCC2(C)C(C1(C)C)=CC=C1C2CCC2(C)C(C(C)CCCC(C)C)CCC21
|
|
| MCULE-6927338637 |
0.71 |
C12(C)CCC3(C4(C)CCC(OC(OCCCCCCCCCCCCCCCC)=O)CC4=CCC3(C1(CCC2C(C)CCCC(C)C)[H])[H])[H]
|
|
| MCULE-6481413773 |
0.71 |
C12(C(C(C)CCCC(C)C)CCC1(C1(C(CC2)(C2(C(=CC1)CC(OC(OCC)=O)CC2)C)[H])[H])[H])C
|
|
| MCULE-8772308175 |
0.71 |
C12(C)CCC(CC1=CCC1C2CCC2(C1CCC2CCCCCCCC)C)OC(OCC(C)CC)=O
|
|
| MCULE-5278298878 |
0.71 |
[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(OCCCCCC)=O
|
|
| MCULE-7149688940 |
0.71 |
[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(OCCCCCCCCCC)=O
|
|
| MCULE-2125546207 |
0.71 |
C12(C)CCC(CC1=CCC1C2CCC2(C1CCC2CCCCCCCC)C)OC(OCCC(C)C)=O
|
|
| MCULE-8563521625 |
0.71 |
[C@]12(C)CC[C@@H](CC1=CCC1C2CC[C@]2(C1CCC2CCCCCCCC)C)OC(OCC(C)CC)=O
|
|
| MCULE-4658579275 |
0.71 |
C(OCCC)(=O)OC1CCC2(C)C3CCC4(C)C(C(C)CCCC(C)C)CCC4C3CC=C2C1
|
|
| MCULE-3637277082 |
0.71 |
O=C(OCC(CC)CCCC)OC1CCC2(C)C3CCC4(C)C(CCCCC(C)C)CCC4C3CC=C2C1
|
|
| MCULE-9695711864 |
0.71 |
C1[C@H](OC(=O)OCCCCCCCCC=CCCCCCCCC)CC2[C@](C1)([C@@]1([H])CC[C@]3(C)[C@@H]([C@H](C)CCCC(C)C)CC[C@@]3([H])[C@]1([H])CC=2)C
|
|
| MCULE-8169764994 |
0.71 |
O=C(OC1CCC2(C)C3CCC4(C)C(C(C)CCC(C)C)CCC4C3CC=C2C1)OC1CCC2(C)C3CCC4(C(CCC4C3CC=C2C1)C(C)CCCC(C)C)C
|
|
| MCULE-6603121364 |
0.71 |
C12(C)CCC(CC1=CCC1C2CCC2(C1CCC2CCCCCCCC)C)OC(OCCCCCCCC)=O
|
|
| MCULE-8094527781 |
0.71 |
C12(C)CCC(CC1=CCC1C2CCC2(C1CCC2CCCCCCCC)C)OC(OCCCCCCCCCC)=O
|
|
| MCULE-8876063223 |
0.71 |
C12(C)CCC(CC1=CCC1C2CCC2(C1CCC2CCCCCCCC)C)OC(OCCCCCCCCCCCCCCCC)=O
|
|
| MCULE-9964219899 |
0.71 |
C12(C)CCC3(C4(C)CCC(OC(OCCCCCCCCC=CCCCCCCCC)=O)CC4=CCC3(C1(CCC2C(C)CCCC(C)C)[H])[H])[H]
|
|
| MCULE-5292387234 |
0.71 |
C1(C)=CC(O)CC(CCCCC)C1C(OC)=O
|
|
| MCULE-2217650928 |
0.71 |
C12(C)CCC(CC1=CCC1C2CCC2(C1CCC2CCCCCCCC)C)OC(OCCCCCCCCC)=O
|
|
| MCULE-5586819307 |
0.71 |
[C@]12(C)CC[C@@H](CC1=CCC1C2CC[C@]2(C1CCC2CCCCCCCC)C)OC(OCCC(C)C)=O
|
|
| MCULE-3881016928 |
0.71 |
[C@]12(C)CC[C@@H](CC1=CCC1C2CC[C@]2(C1CCC2CCCCCCCC)C)OC(OCCCCCCCCCCCCCCCC)=O
|
|
| MCULE-8296958562 |
0.71 |
C12(C)CCC3C(CC=C4CC(CCC34C)OC(OCC(C)CC)=O)C1CCC2C(C)CCCC(C)C
|
|
| MCULE-3179412226 |
0.71 |
CCCCCCCOC(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-3358464796 |
0.71 |
C12(C)CCC3C(CC=C4CC(CCC34C)OC(OCCCCCCCCCCCCCCCCC)=O)C1CCC2C(C)CCCC(C)C
|
|
| MCULE-3676533386 |
0.71 |
CCCCCCOC(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-4850866515 |
0.71 |
CCCCCCCCCCCCOC(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-7029500651 |
0.71 |
[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(OCCCCCCC)=O
|
|
| MCULE-3889003429 |
0.71 |
CCCCCCCCCOC(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-6810524176 |
0.71 |
C12(C)CCC3C(CC=C4CC(CCC34C)OC(OCCC(C)C)=O)C1CCC2C(C)CCCC(C)C
|
|
| MCULE-2883299830 |
0.71 |
CCCCCCCCOC(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-5417022236 |
0.71 |
[C@]12(C)CC[C@@H](CC1=CCC1C2CC[C@]2(C1CCC2CCCCCCCC)C)OC(OCCCCCCCCCC)=O
|
|
| MCULE-4369465090 |
0.71 |
[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(OCCCCCCCC)=O
|
|
| MCULE-8624228699 |
0.71 |
[C@]12(C)CC[C@@H](CC1=CCC1C2CC[C@]2(C1CCC2CCCCCCCC)C)OC(OCCCCCCCCC)=O
|
|
| MCULE-2278704005 |
0.71 |
CCCCCOC(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-1104455109 |
0.71 |
C1(C)(C(C)CCC2(C)C(=CCCC21)C)CC1CC(CCC1OC(C)=O)OC(C)=O
|
|
| MCULE-8296033831 |
0.71 |
C(C)(=O)OC1CCC2(C)C(C1)(C(CC1C3CCC(C(C)C=CC(C)C(C)C)C3(C)CCC12[H])OC(C)=O)[H]
|
|
| MCULE-2151239915 |
0.71 |
C1CC2(C3C(=CCCC3)C3C(CCCC3)O2)CC1
|
|
| MolPort-002-509-853 |
0.71 |
CC(=O)OCC(=O)C1=CCC2C3CC=C4CC(CC[C@]4(C)C3CC[C@]12C)OC(C)=O
|
|
| MolPort-000-755-831 |
0.71 |
CC(=O)OC[C@@]1(C)CC(OC(C)=O)[C@]2(C)CC[C@]3(C)C(C=CC4[C@@]5(C)CCC(OC(C)=O)C(C)(C)C5CC[C@@]34C)=C2C1
|
|
| MolPort-046-153-031 |
0.71 |
CC(=O)OC1CC(O)C(C)(C)C2CC(OC(C)=O)C3(C)C(CCC4(C)C(CC=C34)C3COC(C(O)C3)C(C)(C)O)C12C
|
|
| MolPort-002-511-839 |
0.71 |
CC(=O)OCC(=O)[C@@]1(O)[C@H](O)CC2C3CC=C4CC(CC[C@]4(C)C3CC[C@]12C)OC(C)=O
|
|
| MolPort-000-713-776 |
0.71 |
CC(=O)OCC(=O)[C@@]1(O)[C@H](O)CC2C3CC=C4CC(CCC4(C)C3CCC12C)OC(C)=O
|
|
| MolPort-046-153-148 |
0.71 |
CC1(CCC(=O)O1)C1CC(O)C2(C)C3=C(C(=O)CC12C)C1(C)CCC(=O)C(C)(C)C1CC3O
|
|
| MolPort-028-747-982 |
0.71 |
CCCCCCOC(=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-028-747-991 |
0.71 |
CCCCCOC(=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-046-596-354 |
0.71 |
CCCCCCCCC1CCC2C3CC=C4C[C@H](CC[C@]4(C)C3CC[C@]12C)OC(=O)OCCCCCCC
|
|
| MolPort-002-501-579 |
0.71 |
CCOC(=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-003-712-636 |
0.71 |
CCC(C)COC(=O)OC1CCC2(C)C3CCC4(C)C(CCC4C3CC=C2C1)C(C)CCCC(C)C
|
|
| MolPort-002-528-132 |
0.71 |
CCCCCCCCOC(=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-002-527-976 |
0.71 |
CCCCCCCCCCOC(=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-003-712-635 |
0.71 |
CC(C)CCCC(C)C1CCC2C3CC=C4CC(CCC4(C)C3CCC12C)OC(=O)OCCC(C)C
|
|
| MolPort-046-596-282 |
0.71 |
CCCCCCCCC1CCC2C3CC=C4C[C@H](CC[C@]4(C)C3CC[C@]12C)OC(=O)OCCCCCC
|
|
| MolPort-002-501-668 |
0.71 |
CCCCCCCC\C=C/CCCCCCCCOC(=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-003-701-118 |
0.71 |
CCCCCCCCCCCCCCCCCOC(=O)OC1CCC2(C)C3CCC4(C)C(CCC4C3CC=C2C1)C(C)CCCC(C)C
|
|
| MolPort-002-510-162 |
0.71 |
CCCCCCCCC1CCC2C3CC=C4C[C@H](CC[C@]4(C)C3CC[C@]12C)OC(=O)OCC(C)CC
|
|
| MolPort-028-747-979 |
0.71 |
CCCCCCCOC(=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-003-855-518 |
0.71 |
CCCCCCCCCOC(=O)OC1CCC2(C)C3CCC4(C)C(CCCCCCCC)CCC4C3CC=C2C1
|
|
| MolPort-028-747-972 |
0.71 |
CCCCCCCCOC(=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-044-724-409 |
0.71 |
CCOC(=O)OC1CC[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-006-112-269 |
0.71 |
CC(C)CCC[C@@H](C)[C@H]1CC[C@H]2C3=CC=C4C[C@H](CC[C@]4(C)[C@H]3CC[C@]12C)OC(C)=O
|
|
| MolPort-002-528-707 |
0.71 |
CCCCCCCC[C@H]1CC[C@H]2[C@@H]3CC=C4C[C@H](CC[C@]4(C)[C@H]3CC[C@]12C)OC(=O)OCCCCCCC
|
|
| MolPort-000-770-438 |
0.71 |
CCCCCCCCCCCCCCCCOC(=O)O[C@H]1CC[C@]2(C)C3CC[C@]4(C)C(CCCCCCCC)CCC4C3CC=C2C1
|
|
| MolPort-000-793-856 |
0.71 |
CCCCCCCCCCOC(=O)O[C@H]1CC[C@]2(C)C3CC[C@]4(C)C(CCCCCCCC)CCC4C3CC=C2C1
|
|
| MolPort-000-798-450 |
0.71 |
CCCCCCCCCOC(=O)O[C@H]1CC[C@]2(C)C3CC[C@]4(C)C(CCCCCCCC)CCC4C3CC=C2C1
|
|
| MolPort-003-855-543 |
0.71 |
CCCCCCCCCCOC(=O)OC1CCC2(C)C3CCC4(C)C(CCCCCCCC)CCC4C3CC=C2C1
|
|
| MolPort-003-855-531 |
0.71 |
CCCCCCCCOC(=O)OC1CCC2(C)C3CCC4(C)C(CCCCCCCC)CCC4C3CC=C2C1
|
|
| MolPort-002-530-368 |
0.71 |
CCCCCCCC[C@H]1CC[C@H]2[C@@H]3CC=C4C[C@H](CC[C@]4(C)[C@H]3CC[C@]12C)OC(=O)OCCCCCC
|
|
| MolPort-003-855-504 |
0.71 |
CCCCCCCCC1CCC2C3CC=C4CC(CCC4(C)C3CCC12C)OC(=O)OCC(C)CC
|
|
| MolPort-003-855-500 |
0.71 |
CCCCCCCCCCCCCCCCOC(=O)OC1CCC2(C)C3CCC4(C)C(CCCCCCCC)CCC4C3CC=C2C1
|
|
| MolPort-003-855-495 |
0.71 |
CCCCCCCCC1CCC2C3CC=C4CC(CCC4(C)C3CCC12C)OC(=O)OCCC(C)C
|
|
| MolPort-002-135-317 |
0.71 |
CCCCCC1CC(O)C=C(C)C1C(=O)OC
|
|
| MolPort-028-747-951 |
0.71 |
CCCCCCCCCCCCOC(=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-002-510-465 |
0.71 |
CCCCCCCCC1CCC2C3CC=C4C[C@H](CC[C@]4(C)C3CC[C@]12C)OC(=O)OCCC(C)C
|
|
| MolPort-028-747-963 |
0.71 |
CCCCCCCCCOC(=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-002-511-646 |
0.71 |
C1CCC2(C1)O[C@@H]1CCCCC1C1=CCCCC21
|
|
| MolPort-002-511-730 |
0.71 |
OCCCC[C@@H]1O[C@@H]2CCCCC2C2=CCCCC12
|
|
| MolPort-001-942-595 |
0.71 |
C1CCC2(C1)OC1CCCCC1C1=CCCCC21
|
|
| MolPort-002-508-292 |
0.71 |
C1CCC2(C1)OC1CCCC[C@@H]1C1=CCCCC21
|
|
| MolPort-003-846-187 |
0.71 |
[Na+].CCC(C)(C)C(=O)O[C@H]1C[C@@H](C)C=C2C=C[C@H](C)[C@H](CC[C@H](O)C\C=C\C([O-])=O)[C@@H]12
|
|
| MolPort-003-846-182 |
0.71 |
[Na+].CC[C@H](C)C(=O)O[C@H]1C[C@@H](C)C=C2C=C[C@H](C)[C@H](CC[C@H](O)C\C=C\C([O-])=O)[C@@H]12
|
|
| MolPort-044-637-463 |
0.71 |
CC(C)=CCCC(C1CCC2(C)C3=C(CCC12C)C1(C)CCC(OC(C)=O)C(C)(C)C1CC3)C(O)=O
|
|
| MolPort-039-339-016 |
0.71 |
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-001-936-600 |
0.70 |
CC(OC(C)=O)C12OC1CC1C3CC=C4CC(CCC4(C)C3CCC21C)OC(C)=O
|
|
| MolPort-002-509-166 |
0.70 |
C1CCC2(C1)OC1CCCCC1C1=C2CCCC1
|
|
| MolPort-002-512-831 |
0.70 |
CC(=O)OC1CC2(O)C3CCC4CC(CC[C@]4(C)[C@H]3CC[C@]2(C)C1C1=CC(=O)OC1)OC(C)=O
|
|
| MolPort-002-512-660 |
0.70 |
C[C@H]1C2C(CC3C4CC=C5CC(CC[C@]5(C)C4CC[C@]23C)OC(=O)CCC(O)=O)O[C@]11CCC(C)CO1
|
|
| MolPort-042-646-609 |
0.70 |
CCCCCCCCC1CCC2C3CC=C4C[C@H](CC[C@]4(C)C3CC[C@]12C)OC(=O)C(\C)=C(\C)Cl
|
|
| MolPort-007-549-283 |
0.70 |
CC(C)CCCC(C)C1CCC2C3CC=C4CC(CCC4(C)C3CCC12C)OC(=O)C(\C)=C(\C)Cl
|
|
| MolPort-009-649-142 |
0.70 |
CC(C)CCC[C@@H](C)[C@H]1CCC2C3CC=C4C[C@H](CC[C@]4(C)C3CC[C@]12C)OC(=O)C(\C)=C(/C)Cl
|
|
| MolPort-046-597-601 |
0.70 |
CC(C)CCCC(C)C1CCC2C3CC=C4C[C@H](CC[C@]4(C)C3CC[C@]12C)OC(=O)C(\C)=C(/C)Cl
|
|
| MolPort-005-909-750 |
0.70 |
CC(=O)O[C@H]1C[C@]2(O)[C@@H]3CC[C@@H]4C[C@@H](O)CC[C@]4(C)[C@H]3CC[C@]2(C)[C@H]1C1=CC(=O)OC1
|
|
| MolPort-002-521-459 |
0.70 |
CC(=O)O[C@H]1C[C@]2(O)[C@@H]3CC[C@@H]4C[C@@H](O)CC[C@]4(C)C3CC[C@]2(C)[C@H]1C1=CC(=O)OC1
|
|
| MCULE-9253743476 |
0.70 |
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-5485844450 |
0.70 |
C1CC2(C)C3CCC4(C)C(C(CC/C=C(\C)/C)C(O)=O)CCC4(C)C=3CCC2C(C)(C)C1OC(=O)C
|
|
| MCULE-7458976787 |
0.70 |
C12(C(C)OC(C)=O)C(O1)CC1C3C(CCC21C)C1(C)CCC(CC1=CC3)OC(C)=O
|
|
| MCULE-8347662463 |
0.70 |
[C@]12(C)CCC3C(CC=C4CC(CC[C@]34C)OC(CCC(O)=O)=O)C1CC1C2[C@H](C)[C@]2(O1)CCC(CO2)C
|
|
| MCULE-1909780355 |
0.70 |
[C@]12(C)CC[C@@H](CC1=CCC1C2CC[C@]2(C1CCC2CCCCCCCC)C)OC(=O)C(C)=C(C)Cl
|
|
| MCULE-3230983688 |
0.70 |
C(C)(=O)OC1CCC2(C)C3CCC4(C)C(C5COC(C=5)=O)C(CC4(O)C3CCC2C1)OC(C)=O
|
|
| MCULE-1322261917 |
0.70 |
C12(O)CC(C([C@@]1(C)CC[C@@]1([H])C2([H])CCC2([C@]1(C)CCC(C2)OC(C)=O)[H])C1COC(=O)C=1)OC(C)=O
|
|
| MCULE-2917275236 |
0.70 |
[C@]12(O)C[C@@H]([C@@H]([C@@]1(C)CC[C@@]1([H])[C@@]2([H])CC[C@]2([C@]1(C)CC[C@H](O)C2)[H])C1COC(=O)C=1)OC(C)=O
|
|
| MCULE-4529551060 |
0.70 |
[C@]12(O)C[C@@H]([C@@H]([C@@]1(C)CCC1[C@@]2([H])CC[C@]2([C@]1(C)CC[C@H](O)C2)[H])C1COC(=O)C=1)OC(C)=O
|
|
| MCULE-2782751278 |
0.70 |
[C@]12(C)CCC3C(CC=C4C[C@H](CC[C@]34C)OC(=O)C(C)=C(C)Cl)C1CC[C@]2([H])[C@H](C)CCCC(C)C
|
|
| MCULE-8995686119 |
0.70 |
C12(C)CCC3C(CC=C4CC(CCC34C)OC(=O)C(C)=C(C)Cl)C1CCC2C(C)CCCC(C)C
|
|
| MCULE-2804316805 |
0.70 |
O1C(CC2C1CC=CC2)=O
|
|
| MCULE-9565601037 |
0.70 |
C12CC(OCCO)CCC1(C)C1CCC3(C)C(C(C)CCCC(C)C)CCC3C1CC=2
|
|
| MCULE-7442709707 |
0.70 |
C(C)(=O)OC1CCC2(C)C3C=CC4(C)C(C(C)CCC(OC)=O)CCC4C3CCC2C1
|
|
| MCULE-4894937500 |
0.70 |
[H]C12C=CCCC1(C)C1CC(C3(C)C(C(C)CCC(OC)=O)CCC3C1CC2)OC(C)=O
|
|
| MCULE-7138852957 |
0.70 |
[C@@]12([H])[C@@]([H])(CC3[C@@](C)(C([H])(C)CCC=3)C1([H])O)OC(=O)C2=C
|
|
| MCULE-4800012179 |
0.70 |
O=C1CCC2(COC(C)=O)C3C(CC4(C)C(CCC4(O)C3CCC2=C1)C(OCC)=O)OC(C)=O
|
|
| MCULE-2088102696 |
0.70 |
[C@H]12[C@H](CC3[C@@](C)(C([H])(C)CCC=3)C1([H])O)OC(=O)C2=C
|
|
| MCULE-7005445792 |
0.70 |
C1CC2(C)C(C(C(=O)O)(C)C1)CC=C1C2CC(OC(C)=O)C(C)(C=C)C1
|
|
| MCULE-4045769000 |
0.70 |
C(CCCOC(=O)C)CCC=CCCCC
|
|
| MCULE-3596150007 |
0.70 |
C(CCCCOC(=O)C)CCCCCC=CCCCC
|
|
| MCULE-7933091917 |
0.70 |
C(C)(OCCCCCCCCC=CCCCCCCCC)=O
|
|
| MCULE-7460548556 |
0.70 |
C(C)(=O)OC1CCC2(C)C3CCC4(C)C(=CC)CCC4C3CCC2(C1)[H]
|
|
| MolPort-002-527-443 |
0.70 |
CC1CCC=C2C[C@@H]3OC(=O)C(=C)[C@@H]3C(O)[C@]12C
|
|
| MolPort-039-338-801 |
0.70 |
CC([C@H]1CC[C@@]2(C)[C@@H]3CC[C@H]4C(C)(C)C(=O)CC[C@]4(C)C3=CC[C@]12C)C1CC=C(C)C(=O)O1
|
|
| MolPort-002-528-365 |
0.70 |
CC1CCC=C2C[C@H]3OC(=O)C(=C)[C@H]3C(O)[C@]12C
|
|
| MolPort-035-705-937 |
0.70 |
CC(=O)OC[C@H](O)[C@@]1(C)CC[C@@H]2C(CC[C@@H]3C(C)(C)[C@H](O)CC[C@@]23C)=C1
|
|
| MolPort-001-742-706 |
0.70 |
CC(=O)OC1CC2C(CC1(C)C=C)=CCC1C2(C)CCCC1(C)C(O)=O
|
|
| MolPort-003-959-121 |
0.70 |
CCCCCCCC\C=C/CCCCCCCCOC(C)=O
|
|
| MolPort-003-721-218 |
0.70 |
CC\C=C\CCCCCCCCOC(C)=O
|
|
| MolPort-006-126-833 |
0.70 |
CCCC\C=C/CCCCCCCCCCOC(C)=O
|
|
| MolPort-006-125-474 |
0.70 |
CCC\C=C/CCCCCCCOC(C)=O
|
|
| MolPort-009-019-283 |
0.70 |
CCCCCC\C=C/CCCCCCCCCCOC(C)=O
|
|
| MolPort-003-939-461 |
0.69 |
CC(=O)OC(C)(C)C1CCC(C)=CC1
|
|
| MolPort-035-706-298 |
0.69 |
CC[C@H](CC[C@@H](C)[C@H]1CC[C@H]2[C@@H]3[C@H](OC)C=C4C[C@@H](O)CC[C@]4(C)[C@H]3CC[C@]12C)C(C)C
|
|
| MolPort-002-523-178 |
0.69 |
CC(=O)O[C@H]1CC[C@@]2(C)C(CC[C@]3(C)C2CC[C@@H]2C4[C@@H](CCC=C4CC[C@@]32C)C(C)=C)C1(C)C
|
|
| MolPort-039-338-308 |
0.69 |
CC[C@H](CC[C@@H](C)[C@H]1CC[C@H]2[C@@H]3[C@@H](OC)C=C4C[C@@H](O)CC[C@]4(C)[C@H]3CC[C@]12C)C(C)C
|
|
| MolPort-035-706-333 |
0.69 |
CO[C@H]1C=C2[C@@H](CC[C@H](O)C2(C)C)[C@]2(C)CC[C@]3(C)[C@H](CC[C@@]3(C)[C@H]12)[C@H](C)C\C=C\C(C)(C)OC
|
|
| MolPort-001-921-994 |
0.69 |
CC1CC2=C(CC1COC(C)=O)C(C)(C)CCC2
|
|
| MolPort-007-549-256 |
0.69 |
CCCCC(Br)C(=O)OC1CCC2(C)C3CCC4(C)C(CCC4C3CC=C2C1)C(C)CCCC(C)C
|
|
| MolPort-004-964-842 |
0.69 |
CCCCC1OC(=O)C2=CCCCC12
|
|
| MolPort-000-789-289 |
0.69 |
CCCCCCCCC1CCC2C3CC=C4C[C@H](CC[C@]4(C)C3CC[C@]12C)OC(=O)C(Br)CCCC
|
|
| MolPort-002-841-866 |
0.69 |
CC(=O)OC1CCC2C3C=CC4C(C)(C)C(=O)CCC4(C)C3CCC12C
|
|
| MolPort-000-736-396 |
0.69 |
C1CCC2(C1)OC1CCCCC1C1=CCCCC21.C1CCC2(C1)OC1CCCCC1=C1CCCCC21
|
|
| MolPort-002-501-580 |
0.69 |
COC(=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-003-848-012 |
0.69 |
[Na+].CC[C@H](C)C(=O)O[C@H]1CC=CC2=C[C@@H](O)[C@H](C)[C@H](CC[C@@H](O)C[C@@H](O)CC([O-])=O)[C@@H]12
|
|
| MolPort-046-690-132 |
0.69 |
[Na+].[2H]C([2H])([2H])[C@@H](CC)C(=O)O[C@H]1CC=CC2=C[C@@H](O)[C@H](C)[C@H](CC[C@@H](O)C[C@@H](O)CC([O-])=O)[C@@H]12
|
|
| MolPort-039-338-977 |
0.69 |
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](OC(C)=O)[C@]12C)[C@@]1(C)CC[C@H](O)C(C)(C)C1C[C@@H]3O
|
|
| MCULE-6716714175 |
0.69 |
C1CC(C)=CCC1C(C)(C)OC(=O)C
|
|
| MCULE-9968073626 |
0.69 |
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](OC)C=C2C[C@H]1O
|
|
| MCULE-5465935467 |
0.69 |
C12C(C)(C)CCCC=1CC(C)C(COC(C)=O)C2
|
|
| MCULE-5965392040 |
0.69 |
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](OC)C=C2C[C@H]1O
|
|
| MCULE-1876019392 |
0.69 |
[C@]12(C)CC[C@@H](CC1=CCC1C2CC[C@]2(C1CCC2CCCCCCCC)C)OC(C(CCCC)Br)=O
|
|
| MCULE-1920197645 |
0.69 |
C12(C)CCC3C(CC=C4CC(CCC34C)OC(C(CCCC)Br)=O)C1CCC2C(C)CCCC(C)C
|
|
| MCULE-6440147345 |
0.69 |
O1C(C2=CCCCC2C1CCCC)=O
|
|
| MCULE-7768798034 |
0.69 |
C(C)(=O)OC1CCC2(C)C(O)(C1)CCC1=C3CCC(C(C)CCC(C)C(C)C)C3(C)CCC21
|
|
| MCULE-2039968402 |
0.69 |
C12(C)CCC(C(C)(C)C1C=CC1C3C(C)(C(CC3)OC(C)=O)CCC21)=O
|
|
| MCULE-5492237592 |
0.69 |
C(O[C@@]1(CC2=CC[C@]3([C@@]4(CC[C@@]([C@@]4(C)CC[C@@]3([C@@]2(C)CC1)[H])([C@](C)(CCCC(C)C)[H])[H])[H])[H])[H])(=O)OC
|
|
| MCULE-2780089397 |
0.69 |
C1(C)(/C=C/C(CCC(O)=O)(O)C)C2CCC(=O)OC(C)(C)C2CC1
|
|
| MCULE-3051029416 |
0.69 |
C12(C(C(C)CCCC(C)C)CCC1(C1(C(CC2)(C2(C(=CC1)CC(OC(OC)=O)CC2)C)[H])[H])[H])C
|
|
| MCULE-1028193763 |
0.69 |
C1C(O)C2(C(C3C(CC2)C(=C)C(=O)O3)C(C)=C1)C
|
|
| MCULE-2266958285 |
0.69 |
C12(COC(C)=O)COC(C(C(C)=CC1C)C2C)C=C
|
|
| MCULE-3521793580 |
0.69 |
C1[C@@H](O)[C@]2(C)CC[C@H]3C(=C)C(=O)O[C@@H]3[C@@]2([H])C(C)=C1
|
|
| MCULE-6843594884 |
0.69 |
C12=CCCCC1C1(OC3CCCCC23)CCCCC1
|
|
| MCULE-1906795397 |
0.69 |
C(C)(=O)OC1CCC2(C)C(C1)(CC=C1C3CCC(C(C)C=CC(C)C(C)C)C3(C)CC(C21[H])=O)OC(C)=O
|
|
| MCULE-3605740875 |
0.69 |
C(C)(=O)OC1CCC2(C)C(C1)(CC(C1C3CCC(C(C)C=CC(C)C(C)C)C3(C)CC=C21)=O)OC(C)=O
|
|
| MCULE-1363593102 |
0.69 |
C(C)(=O)OC1CCC2(C)C3(C1)C(C=C1C4CCC(C(C)C=CC(C)C(C)C)C4(C)CCC12[H])O3
|
|
| MCULE-7653931965 |
0.69 |
C12(C)CCC(CC1=CCC1C2CCC2(C1CCC2NC(C)=O)C)OC(C)=O
|
|
| MCULE-1880394496 |
0.69 |
[C@]12(C)CCC3C(CC=C4CC(CC[C@]34C)OC(C)=O)C1C[C@@H](C)C2NC(C)=O
|
|
| MCULE-2652266780 |
0.69 |
C(C=CCCCCCCCC(=O)OCCCC)[C@H](O)CCCCCC
|
|
| MCULE-3579684120 |
0.69 |
O1CCOC21CCC1(C)C(C2OC(C)=O)=CCC2C1CCC1(C)C(C(C)CCCC(C)C)CCC12
|
|
| MCULE-5092604458 |
0.69 |
CC1OCC(C2CCCCC=2)(O)CC1
|
|
| MCULE-7448178395 |
0.69 |
[C@H]12C(CCC(C)=C3CCC(C)(O)C13)C(C(=O)O2)C
|
|
| MolPort-045-968-441 |
0.69 |
CC1C=C(C)C2C(C)C1(COC(C)=O)COC2C=C
|
|
| MolPort-005-945-167 |
0.69 |
CC1=CCC(O)C2(C)CCC3C(OC(=O)C3=C)C12
|
|
| MolPort-046-067-657 |
0.69 |
CC1C=C(C)C2[C@H](C)C1(COC(C)=O)COC2C=C
|
|
| MolPort-044-183-328 |
0.69 |
CCCCC[C@H](O)\C=C\[C@H]1[C@H](O)C[C@@H]2OC(=O)CCC\C=C/C[C@H]12
|
|
| MolPort-035-706-215 |
0.69 |
CC1=CC[C@@H](O)[C@]2(C)CC[C@@H]3[C@H](OC(=O)C3=C)[C@@H]12
|
|
| MolPort-002-511-651 |
0.69 |
C1CCC2(CC1)O[C@@H]1CCCCC1C1=CCCCC21
|
|
| MolPort-002-135-199 |
0.69 |
CCCC1OC2CCCCC2C2=CCCCC12
|
|
| MolPort-001-942-596 |
0.69 |
C1CCC2(CC1)OC1CCCCC1C1=CCCCC21
|
|
| MolPort-002-135-200 |
0.69 |
CC(C)C1OC2CCCCC2C2=CCCCC12
|
|
| MolPort-002-710-560 |
0.69 |
CC(=O)NC1CCC2C3CC=C4CC(CC[C@]4(C)C3CC[C@]12C)OC(C)=O
|
|
| MolPort-002-508-614 |
0.69 |
C[C@@H]1CC2C3CC=C4CC(CC[C@]4(C)C3CC[C@]2(C)C1NC(C)=O)OC(C)=O
|
|
| MolPort-039-338-374 |
0.69 |
CC(=O)O[C@H]1CC[C@]2(C)[C@@H](CC\C(C)=C\C(O)=O)C(=C)CC[C@H]2C1(C)C
|
|
| MolPort-044-755-229 |
0.69 |
CC(=O)O[C@H]1CCC2[C@H]3CC[C@]4(C)C(=O)CCC4=C3C[C@@H](O)[C@]2(C)C1
|
|
| MolPort-046-793-005 |
0.69 |
CCCCCC\C=C/CCCCCCCC(=O)O[C@H]1CC[C@]2(C)[C@H]3CC[C@]4(C)[C@H](CC[C@H]4C3=CC=C2C1)[C@H](C)CCCC(C)C
|
|
| MolPort-046-793-004 |
0.69 |
CCCCCCCC\C=C/CCCCCCCC(=O)O[C@H]1CC[C@]2(C)[C@H]3CC[C@]4(C)[C@H](CC[C@H]4C3=CC=C2C1)[C@H](C)CCCC(C)C
|
|
| MolPort-042-646-605 |
0.69 |
CCCCCCCCC1CCC2C3CC=C4C[C@H](CC[C@]4(C)C3CC[C@]12C)OC(=O)C(Cl)CCCCC
|
|
| MolPort-007-549-257 |
0.69 |
CCCCCC(Cl)C(=O)OC1CCC2(C)C3CCC4(C)C(CCC4C3CC=C2C1)C(C)CCCC(C)C
|
|
| MolPort-046-067-633 |
0.69 |
C\C=C\C1OCC2(COC(C)=O)C(C)C=C(C)C1[C@@H]2C
|
|
| MolPort-007-549-258 |
0.69 |
CCCCCCCC(Cl)C(=O)OC1CCC2(C)C3CCC4(C)C(CCC4C3CC=C2C1)C(C)CCCC(C)C
|
|
| MolPort-002-530-131 |
0.69 |
CCCCCCCC[C@H]1CC[C@H]2[C@@H]3CC=C4C[C@H](CC[C@]4(C)[C@H]3CC[C@]12C)OC(=O)C(Cl)CCCCC
|
|
| MolPort-046-761-511 |
0.68 |
CC12C=CC[C@@]3(OC1=O)[C@@H]1CC[C@]4(O)C[C@]1(CC4=C)[C@H]([C@H]23)C(O)=O
|
|
| MolPort-002-522-252 |
0.68 |
C[C@]12CCC3C(CC=C4CC(O)CC[C@]34C)C1CC[C@@]21CCO1
|
|
| MolPort-046-702-693 |
0.68 |
CC(CCC1OC1(C)C)C1CCC2C3CC=C4CC(O)CCC4(C)C3CCC12C
|
|
| MolPort-020-001-442 |
0.68 |
CC[C@H](C)C(=O)O[C@H]1C[C@H](O)C=C2C=C[C@H](C)[C@H](CC[C@@H](O)C[C@@H](O)CC(O)=O)C12
|
|
| MolPort-006-167-482 |
0.68 |
CC[C@H](C)C(=O)O[C@H]1C[C@H](O)C=C2C=C[C@H](C)[C@H](CC[C@@H](O)C[C@@H](O)CC(O)=O)[C@@H]12
|
|
| MolPort-046-598-120 |
0.68 |
CC[C@H](C)C(=O)O[C@H]1C[C@H](O)C=C2C=C[C@H](C)[C@H](CC[C@@H](O)C[C@@H](O)CC([O-])=O)[C@@H]12
|
|
| MolPort-002-886-211 |
0.68 |
CC(=O)OC1CC2CC1C1C=CCC21
|
|
| MolPort-002-215-588 |
0.68 |
CCOC(C\C(C)=C\CO)C1=C(C)CCCC1(C)C
|
|
| MolPort-044-755-228 |
0.68 |
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-046-765-314 |
0.68 |
CCCCCCCCCCC[C@@H]1CC=C(CCCCCC)C(=O)O1
|
|
| MolPort-002-507-458 |
0.68 |
C[C@]12CCC3[C@@H](CC=C4CC5(CC[C@]34C)OCCO5)C1CC[C@@]21CCC(=O)O1
|
|
| MolPort-002-511-297 |
0.68 |
C[C@]12CCC3C(CC=C4CC5(CC[C@]34C)OCCO5)C1CC[C@@]21CCC(=O)O1
|
|
| MolPort-044-755-249 |
0.68 |
CC(=O)O[C@@H]1CC2=C(CC[C@H]3[C@H]2CC=C2C[C@H](CC[C@]32C)OC(C)=O)[C@]1(C)C(C)=O
|
|
| MolPort-001-742-454 |
0.68 |
CC1=CC[C@H](O)[C@@]2(C)C[C@@H](O)[C@@H]3[C@@H](OC(=O)C3=C)[C@H]12
|
|
| MCULE-1964134852 |
0.68 |
C12=C(C)CC[C@@]1([H])C(=C)C[C@@H](OC(C)=O)C(C)(C)C2
|
|
| MCULE-1502775418 |
0.68 |
C12=CCC(C1(C)CCC1C2CCC2(C1(CO)CCC(O)C2)[H])C1COC(=O)C=1
|
|
| MCULE-7353523388 |
0.68 |
[C@]12(O)C[C@@H]([C@@H]([C@@]1(C)CC[C@@]1([H])[C@@]2([H])CC[C@]2([C@]1(C)CC[C@H](O)C2)[H])C1COC(=O)C=1)O
|
|
| MCULE-1759828525 |
0.68 |
[C@H]12[C@@]([H])(CCC(C)=C3C(CC(C)[C@]13[H])=O)[C@@H](C(=O)O2)C
|
|
| MCULE-8590167000 |
0.68 |
C1(O)CCC2(C)C3CCC4(C)C(C5COC(=O)C=5)C(O)CC4(O)C3CCC2C1
|
|
| MCULE-3134722068 |
0.68 |
C12(C)CCC3C(CC=C4CC(CCC34C)OC(=O)C/C(/Cl)=C(/Cl)\Cl)C1CCC2C(C)CCC(CC)C(C)C
|
|
| MCULE-3077119951 |
0.68 |
[C@]12(C)CCC3C(CC=C4C[C@H](CC[C@]34C)OC(=O)C/C(/Cl)=C(\Cl)/Cl)C1CC[C@@H]2[C@H](C)/C=C/C(CC)C(C)C
|
|
| MCULE-1305866944 |
0.68 |
O1C2C(C3CCCC=3C1=O)CCCC2
|
|
| MCULE-8380731028 |
0.68 |
C12[C@@H](C)C[C@@H](C[C@]1(C)C[C@@H]1[C@H](C=2)C(=C)C(O1)=O)O
|
|
| MCULE-9071665055 |
0.68 |
C12(C)CCC3C(CC=C4CC(CCC34C)OC(=O)C/C(/Cl)=C(\Cl)/Cl)C1CCC2C(C)CCCC(C)C
|
|
| MCULE-7804523078 |
0.68 |
[C@]12(C)CCC3C(CC=C4C[C@H](CC[C@]34C)OC(=O)C/C(/Cl)=C(/Cl)\Cl)C1CC[C@@H]2[C@H](C)CC[C@H](CC)C(C)C
|
|
| MCULE-1564688046 |
0.68 |
O[C@@H]1C[C@@H]2OC(=O)C[C@@H]2[C@H]1/C=C/[C@@H](O)CCCCC
|
|
| MCULE-5209430484 |
0.68 |
[C@]12(C)CCC3C(CC=C4C[C@H](CC[C@]34C)OC(=O)C/C(/Cl)=C(\Cl)/Cl)C1CC[C@@H]2[C@H](C)CCCC(C)C
|
|
| MCULE-2528636479 |
0.68 |
C12(C)CCC3C(CC=C4CC(CCC34C)OC(=O)C/C(/Cl)=C(\Cl)/Cl)C1CCC2C(C)C=CC(CC)C(C)C
|
|
| MCULE-7738893054 |
0.68 |
[Na+].C12=C[C@@H](O)C[C@H](OC([C@@H](C)CC)=O)[C@]1([H])[C@H]([C@@H](C)C=C2)CC[C@@H](O)C[C@@H](O)CC(=O)[O-]
|
|
| MCULE-8752496358 |
0.68 |
[O-]C(=O)C[C@H](O)C[C@H](O)CC[C@@H]1[C@]2([H])C(=C[C@@H](O)C[C@@H]2OC(=O)[C@@H](C)CC)C=C[C@@H]1C.[Na+]
|
|
| MCULE-5372325704 |
0.68 |
[Na+].CCC(C(OC1C2C(C=CC(C2CCC(CC(CC(=O)[O-])O)O)C)=CC(O)C1)=O)C
|
|
| MCULE-5123565274 |
0.68 |
[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(C(CCCCC)Cl)=O
|
|
| MCULE-3703044544 |
0.68 |
C12(C)CCC3C(CC=C4CC(CCC34C)OC(C(CCCCC)Cl)=O)C1CCC2C(C)CCCC(C)C
|
|
| MCULE-1324256010 |
0.68 |
C(C)(=O)OC1CCC2(C)C(C1)(CCC1C3=CCC(C(C)C=CC(C)C(C)C)C3(C)CCC2=1)OC(C)=O
|
|
| MCULE-1714041310 |
0.68 |
[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)COC(CBr)=O)[H]
|
|
| MCULE-2605268753 |
0.68 |
C(COC(=O)CCC(=O)O)(C)(COC(=O)CCC(=O)O)C(=O)O[C@@H]1CC2=CC[C@@]3([H])[C@]4([H])CC[C@@]([H])(C4(CC[C@]3([H])[C@@]2(C)CC1)C)[C@H](C)CCCC(C)C
|
|
| MCULE-6804658031 |
0.68 |
C12(C)CCC3C(CC=C4CC(CCC34C)OC(C(CCCCCCC)Cl)=O)C1CCC2C(C)CCCC(C)C
|
|
| MCULE-7117182009 |
0.68 |
OC(=O)C[C@@H](C[C@@H](CC[C@@H]1[C@]2([H])C(=C[C@H](C[C@@H]2OC(=O)[C@H](CC)C)O)C=C[C@@H]1C)O)O
|
|
| MCULE-9320823035 |
0.68 |
C([C@H]1[C@H](C=CC2=C[C@@H](O)C[C@H](OC(=O)[C@@H](C)CC)[C@]12[H])C)C[C@@H](O)C[C@@H](O)CC(=O)O
|
|
| MCULE-6290890593 |
0.68 |
CCC(C(OC1C2C(C=CC(C2CCC(CC(CC(=O)[O-])O)O)C)=CC(O)C1)=O)C
|
|
| MCULE-8218822760 |
0.68 |
C12CC(C3CC=CC13)CC2OC(C)=O
|
|
| MCULE-7177658171 |
0.68 |
C1(C(C)(C)CCCC=1C)C(OCC)CC(C)=CCO
|
|
| MCULE-2525034164 |
0.68 |
C1CCC(C(C)(C(OCC)=O)C)=CCCC1
|
|
| MCULE-9193800742 |
0.68 |
C1CC(OC(C)=O)C=CCCC1
|
|
| MCULE-3754883080 |
0.68 |
C(OCC)(C(CC)C1=CCCCC1)=O
|
|
| MCULE-1835452878 |
0.68 |
C(C)(=O)OC1CC2(C)C3CCC4(C)C(CCC4C3CCC2=CC1=O)=O
|
|
| MCULE-6277226641 |
0.68 |
[C@]12(C)CCC3[C@@]([H])(CC=C4CC5(OCCO5)CC[C@]34C)C1CC[C@]12CCC(=O)O1
|
|
| MCULE-4246019761 |
0.68 |
C(C)(=O)OC1CC2(C3CCC4(C)C(CCC4C3CCC2=CC1=O)OC(C)=O)[H]
|
|
| MCULE-8469102313 |
0.68 |
C(C)(=O)OC1CC2(C)C3CCC4(C)C(C(C)CCCC(C)C)CCC4C3CCC2=CC1=O
|
|
| MCULE-8726454334 |
0.68 |
[C@@]12(C)[C@@H](O)CC=C(C)[C@@]1([H])[C@H]1[C@H](C(C(=O)O1)=C)[C@H](O)C2
|
|
| MCULE-7567944474 |
0.68 |
C(C)(=O)OC1CCC2(C)C(O)(C1)C(C=C1C3CCC(C(C)C=CC(C)C(C)C)C3(C)CCC12[H])OC(C)=O
|
|
| MCULE-9132874288 |
0.68 |
C12(C)CCC3C(CC=C4CC(CCC34C)OC(=O)CC[NH+]3CCCCC3)C1CCC2C(C)CCCC(C)C
|
|
| MCULE-6426429596 |
0.68 |
O(C(C)=O)C1CC2C(=O)OCC=2C2(C)C1C1(COC1=O)CCC2
|
|
| MCULE-8055009685 |
0.68 |
C1(CC(CCC1C(C)=C)C)OC(C)=O
|
|
| MCULE-5808724300 |
0.68 |
[C@]12(C)CCC3[C@@]([H])(CC=C4C[C@@H](OC)CC[C@]34C)C1CC[C@@H]2[C@H](C)C=C[C@H](CC)C(C)C
|
|
| MCULE-3798887300 |
0.68 |
[C@]12(C)CCCC(C)(C)[C@]1([H])[C@H](CC(=C)[C@H]2CCC(C)(C=C)OC(C)=O)OC(C)=O
|
|
| MCULE-4054169015 |
0.68 |
C12=C(C)CCC1C(=C)CC(OC(C)=O)C(C)(C)C2
|
|
| MolPort-002-515-918 |
0.68 |
CC(C)CCCC(C)C1CCC2C3CC=C4CC(CC[C@]4(C)C3CC[C@]12C)OC(=O)CCN1CCCCC1
|
|
| MolPort-046-597-004 |
0.68 |
CC(C)CCCC(C)C1CCC2C3CC=C4CC(CC[C@@]4(C)C3CC[C@@]12C)OC(=O)CCN1CC(C)CC(C)C1
|
|
| MolPort-046-697-193 |
0.68 |
CC(=O)OC1CC2=C(COC2=O)C2(C)CCCC3(COC3=O)C12
|
|
| MolPort-002-522-880 |
0.68 |
CC[C@@H](\C=C\[C@@H](C)[C@H]1CCC2[C@@H]3CC=C4C[C@H](CC[C@]4(C)C3CC[C@]12C)OC)C(C)C
|
|
| MolPort-044-721-499 |
0.68 |
CC(=O)OC1CC(=C)C2CCC(C)=C2CC1(C)C
|
|
| MolPort-002-524-438 |
0.68 |
CC(=O)O[C@@H]1CC(=C)[C@@H]2CCC(C)=C2CC1(C)C
|
|
| MolPort-000-742-883 |
0.68 |
C1CCC2(CC1)OC1CCCCC1=C1CCCCC21.C1CCC2(CC1)OC1CCCCC1C1=CCCCC21
|
|
| MolPort-001-932-115 |
0.68 |
CC(=O)OCC(=O)C1(O)CCC2C3CC=C4CC(O)CCC4(C)C3CCC12C
|
|
| MolPort-005-911-057 |
0.68 |
CC12CCC3C(CCC4CC(O)CCC34CO)C1=CCC2C1=CC(=O)OC1
|
|
| MolPort-002-507-401 |
0.68 |
CC(=O)OCC(=O)[C@@]1(O)CCC2C3CC=C4CC(O)CC[C@]4(C)C3CC[C@]12C
|
|
| MolPort-002-524-164 |
0.68 |
C[C@@H]1CC2[C@@H]3CC=C4C[C@@H](O)CC[C@]4(C)C3CC[C@]2(C)[C@@]1(O)C(=O)COC(C)=O
|
|
| MolPort-001-827-199 |
0.68 |
CC12CCC3C(CCC4CC(O)CCC34C)C1(O)CC(O)C2C1=CC(=O)OC1
|
|
| MolPort-007-549-368 |
0.68 |
CC12CC[C@H]3C(CCC4CC(O)CCC34C)C1(O)CC(O)C2C1=CC(=O)OC1
|
|
| MolPort-002-525-351 |
0.68 |
CC1CC(=O)C2=C(C)CC[C@H]3[C@H](C)C(=O)O[C@@H]3[C@@H]12
|
|
| MolPort-002-510-868 |
0.68 |
C[C@]12CC[C@H]3[C@@H](CC[C@@H]4C[C@@H](O)CC[C@]34C)[C@@]1(O)C[C@H](O)[C@@H]2C1=CC(=O)OC1
|
|
| MolPort-000-725-088 |
0.68 |
CC(=O)OCC(=O)[C@@]1(O)CCC2C3CC=C4CC(O)CCC4(C)C3CCC12C
|
|
| MolPort-046-596-360 |
0.68 |
C[C@@H]1CC2C3CC=C4CC(O)CC[C@]4(C)C3CC[C@]2(C)[C@@]1(O)C(=O)COC(C)=O
|
|
| MolPort-002-727-074 |
0.68 |
CC(C)CCC[C@@H](C)[C@H]1CCC2C3CC=C4C[C@H](CC[C@]4(C)C3CC[C@]12C)OC(=O)CC(Cl)=C(Cl)Cl
|
|
| MolPort-001-742-429 |
0.68 |
C[C@H]1C[C@H](O)C[C@]2(C)C[C@H]3OC(=O)C(=C)[C@H]3C=C12
|
|
| MolPort-002-727-075 |
0.68 |
CC[C@@H](CC[C@@H](C)[C@H]1CCC2C3CC=C4C[C@H](CC[C@]4(C)C3CC[C@]12C)OC(=O)CC(Cl)=C(Cl)Cl)C(C)C
|
|
| MolPort-002-727-073 |
0.68 |
CCC(\C=C\[C@@H](C)[C@H]1CCC2C3CC=C4C[C@H](CC[C@]4(C)C3CC[C@]12C)OC(=O)CC(Cl)=C(Cl)Cl)C(C)C
|
|
| MolPort-046-792-772 |
0.67 |
[Na+].CCC(C)(C)C(=O)O[C@@H]1CC(C)(O)C=C2C=C[C@H](C)[C@H](CC[C@@H](O)C[C@@H](O)CC([O-])=O)[C@@H]12
|
|
| MolPort-006-395-743 |
0.67 |
[Na+].[2H]C([2H])([2H])[C@@H](CC)C(=O)O[C@H]1C[C@H](O)C=C2C=C[C@H](C)[C@H](CC[C@@H](O)C[C@@H](O)CC([O-])=O)[C@@H]12
|
|
| MolPort-046-790-373 |
0.67 |
C[C@@H]([C@H]1CC[C@H]2[C@@H]3C[C@H](O)[C@]4(O)[C@@H](O)C=CC(=O)[C@]4(C)[C@H]3CC[C@]12C)[C@H]1CC(C)=C(CO)C(=O)O1
|
|
| MolPort-002-885-849 |
0.67 |
[Na+].CC[C@H](C)C(=O)O[C@H]1C[C@H](O)C=C2C=C[C@H](C)[C@H](CCC(O)C[C@@H](O)CC([O-])=O)[C@@H]12
|
|
| MolPort-046-689-946 |
0.67 |
[Na+].CCC[C@H](C)C(=O)O[C@H]1C[C@H](O)C=C2C=C[C@H](C)[C@H](CC[C@@H](O)C[C@H](O)CC([O-])=O)[C@@H]12
|
|
| MolPort-046-763-325 |
0.67 |
CCOC(=O)CCC[C@@H](C)[C@H]1CC[C@H]2[C@H]3[C@H](CC[C@]12C)[C@@]1(C)CC[C@H](OC(C)=O)[C@H](OC(C)=O)C1=CC3=O
|
|
| MolPort-003-849-962 |
0.67 |
[Na+].CC[C@H](C)C(=O)O[C@H]1C[C@H](O)C=C2C=C[C@H](C)[C@H](CC[C@@H](O)C[C@@H](O)CC([O-])=O)[C@@H]12
|
|
| MolPort-046-690-129 |
0.67 |
[Na+].C[C@@H](O)[C@H](C)C(=O)O[C@H]1C[C@H](O)C=C2C=C[C@H](C)[C@H](CC[C@@H](O)C[C@@H](O)CC([O-])=O)[C@@H]12
|
|
| MolPort-023-219-582 |
0.67 |
[Na+].CC[C@H](C)C(=O)OC1C[C@H](O)C=C2C=C[C@H](C)[C@H](CC[C@@H](O)C[C@@H](O)CC([O-])=O)[C@@H]12
|
|
| MolPort-028-754-123 |
0.67 |
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-002-511-376 |
0.67 |
CC1CC(CCC=C(C)C)=CCC1COC(C)=O
|
|
| MolPort-000-744-313 |
0.67 |
CC1C=C(C)C2C(C)C1COC21CCCC1
|
|
| MolPort-039-052-574 |
0.67 |
CC(C)=CCCC(=C)[C@H]1CC[C@]2(C)[C@@H]1CC[C@@H]1[C@@]3(C)CC[C@H](OC(C)=O)C(C)(C)[C@@H]3CC[C@@]21C
|
|
| MolPort-046-067-692 |
0.67 |
CC1C=C(C)C2[C@H](C)C1COC21CCCC1
|
|
| MolPort-035-706-457 |
0.67 |
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-007-549-413 |
0.67 |
CC12CC[C@H]3[C@@H](CCC4CC(O)CCC34C)C1(O)CC[C@H]2C1=CC(=O)OC1
|
|
| MolPort-006-111-351 |
0.67 |
C[C@]12CC[C@H]3[C@@H](CC[C@H]4C[C@@H](O)CC[C@]34C)[C@@]1(O)CC[C@@H]2C1=CC(=O)OC1
|
|
| MolPort-002-513-646 |
0.67 |
C[C@]12CC[C@H]3[C@@H](CC[C@@H]4C[C@@H](O)CC[C@]34C)[C@@]1(O)CC[C@@H]2C1=CC(=O)OC1
|
|
| MolPort-002-524-753 |
0.67 |
C[C@]12CCC3[C@@H](CC[C@H]4C[C@@H](O)CC[C@]34C)[C@@]1(O)CC[C@@H]2C1=CC(=O)OC1
|
|
| MolPort-001-740-957 |
0.67 |
CC(CC[C@@]1(C)[C@H](C)CC[C@]2(C)C1CCC=C2COC(C)=O)CC(O)=O
|
|
| MolPort-001-836-303 |
0.67 |
CC(=O)O[C@H]1CC[C@@]2(C)[C@H](CC[C@@H]3[C@@H]2CC[C@]2(C)[C@H](CC[C@]32O)C2=CC(=O)OC2)C1
|
|
| MolPort-046-596-961 |
0.67 |
CC(=O)OC1CC[C@@]2(C)C(CCC3[C@@H]2CC[C@]2(C)[C@@H](CCC32O)C2=CC(=O)OC2)C1
|
|
| MolPort-000-847-946 |
0.67 |
CC12CCC3C(CCC4CC(O)CCC34C)C1(O)CCC2C1=CC(=O)OC1
|
|
| MolPort-028-854-624 |
0.67 |
C[C@]12CC[C@H]3[C@@H](CC[C@@H]4C[C@@H](O)CC[C@]34CO)[C@@]1(O)CC[C@@H]2C1=CC(=O)OC1
|
|
| MolPort-044-755-256 |
0.67 |
CCCC(=O)O[C@@H]1CC2=C(CC[C@H]3[C@H]2CC=C2C[C@H](CC[C@]32C)OC(C)=O)[C@]1(C)C(C)=O
|
|
| MolPort-046-597-757 |
0.67 |
CC(OC(C)=O)[C@]1(CCC2C3CCC4=CC(CC[C@]4(C)C3CC[C@]12C)OC(C)=O)OC(C)=O
|
|
| MolPort-001-739-749 |
0.67 |
CC1=CCC2C(C)(C)CCCC2(C)C1CC12OC1C(O)C(CO)=CC2O
|
|
| MolPort-046-697-223 |
0.67 |
CC1=CCC2C(C)(C)C(O)CCC2(C)C1CC12OC1C(O)C(CO)=CC2O
|
|
| MolPort-002-512-074 |
0.67 |
CC(=O)C1CCC2C3CCC4=CC(=O)CC[C@]4(COC(=O)CCC(O)=O)C3CC[C@]12C
|
|
| MolPort-002-527-934 |
0.67 |
CC(OC(C)=O)[C@]1(CC[C@H]2[C@@H]3CCC4=C[C@H](CC[C@]4(C)[C@H]3CC[C@]12C)OC(C)=O)OC(C)=O
|
|
| MolPort-002-525-199 |
0.67 |
CC(=O)OC1CC[C@]2(C)C3CC[C@@]4(C)C(CC[C@@]44CCC(=O)O4)[C@@H]3CCC2=C1
|
|
| MolPort-000-712-846 |
0.67 |
[Cl-].CC(C)CCCC(C)C1CCC2C3CC=C4CC(CC[C@@]4(C)C3CC[C@@]12C)OC(=O)CC[NH+]1CC(C)CC(C)C1
|
|
| MolPort-046-596-523 |
0.67 |
C[C@]12CCC3C(CC=C4CC(CC[C@]34C)OC(=O)CCN3CCCC3)C1CCC2=O
|
|
| MolPort-046-790-483 |
0.67 |
C[C@@H](CCCOC(C)=O)C1=C(C)C[C@H]2OC(=O)C(=C)[C@H]2[C@H]1O
|
|
| MolPort-039-338-340 |
0.67 |
CC(CCCOC(C)=O)C1=C(C)C[C@H]2OC(=O)C(=C)[C@H]2[C@H]1O
|
|
| MolPort-029-943-098 |
0.67 |
CC(CCCO)C1=C(C)CC2OC(=O)C(=C)C2C1O
|
|
| MolPort-009-758-554 |
0.67 |
Cl.CC(C)CCC[C@@H](C)[C@H]1CCC2C3CC=C4C[C@H](CC[C@]4(C)C3CC[C@]12C)OC(=O)CCN1CC(C)CC(C)C1
|
|
| MolPort-029-943-083 |
0.67 |
C[C@@H](CCCOC(C)=O)C1=C(C)C[C@H]2OC(=O)C(=C)[C@H]2[C@@H]1O
|
|
| MolPort-046-765-474 |
0.67 |
C[C@]12CC[C@]34OC(=O)[C@H](CC5=CC(=O)CC[C@]35C)C4[C@@H]1CC[C@@]21CCC(=O)O1
|
|
| MolPort-002-514-788 |
0.67 |
CCOC(=O)CC(C)(O)[C@@]12O[C@@H]1CC1C3CC=C4CC(CC[C@]4(C)C3CC[C@]21C)OC(C)=O
|
|
| MolPort-046-761-035 |
0.67 |
CC(=O)O[C@H]1C[C@H]2[C@@H](OC(C)=O)[C@@H]3C(=C)[C@@H](O)C[C@H](OC(C)=O)[C@@]3(C)[C@@H](OC(C)=O)[C@H](OC(C)=O)C(=C1C)C2(C)C
|
|
| MolPort-046-158-516 |
0.67 |
C[C@@H](CCCO)C1=C(C)C[C@H]2OC(=O)C(=C)[C@H]2[C@@H]1O
|
|
| MolPort-044-754-102 |
0.67 |
CC(CCCO)C1=C(C)C[C@H]2OC(=O)C(=C)[C@H]2[C@H]1O
|
|
| MolPort-000-728-401 |
0.67 |
[Cl-].CC(C)CCCC(C)C1CCC2C3CC=C4CC(CCC4(C)C3CCC12C)OC(=O)CC[NH+]1CCCCC1
|
|
| MolPort-009-758-108 |
0.67 |
Cl.CC(C)CCC[C@@H](C)[C@H]1CCC2C3CC=C4C[C@H](CC[C@]4(C)C3CC[C@]12C)OC(=O)CCN1CCCCC1
|
|
| MolPort-002-514-423 |
0.67 |
COC1([C@H](O)CC2C3CC=C4CC(CC[C@]4(C)C3CC[C@]12C)OC(C)=O)C(\C)=N\O
|
|
| MCULE-5462014053 |
0.67 |
C1(C)=CC(C)C2C(C)C1C1(CCCC1)OC2
|
|
| MCULE-6799150619 |
0.67 |
C1(CC/C=C(/C)\C)CC(C)C(CC=1)COC(C)=O
|
|
| MCULE-6906348244 |
0.67 |
C(C)(=O)OC1CCC2(C)C([H])(C1)CC=C1C3CCC(C(C)C=CC(C)C(C)C)C3(C)CC(C21C)=O
|
|
| MCULE-3280168913 |
0.67 |
C1C(C(CCC=1C)CC(OCC)=O)O
|
|
| MCULE-3998827933 |
0.67 |
C1CC2[C@@](CC[C@H]([C@]2(C)CCC(C)CC(=O)O)C)(C(COC(=O)C)=C1)C
|
|
| MCULE-7391544076 |
0.67 |
[C@]12(O)CC[C@@H]([C@@]1(C)CC[C@@]1([H])[C@@]2([H])CC[C@]2([C@]1(C)CC[C@H](O)C2)[H])C1COC(=O)C=1
|
|
| MCULE-6340794511 |
0.67 |
[C@]12(O)CC[C@@H]([C@@]1(C)CC[C@@]1([H])[C@@]2([H])CC[C@]2([C@]1(C)CC[C@@H](C2)OC(C)=O)[H])C1COC(=O)C=1
|
|
| MCULE-1542720935 |
0.67 |
C12(O)CCC(C1(C)CCC1C2CCC2C1(C)CCC(O)C2)C1COC(=O)C=1
|
|
| MCULE-5690818300 |
0.67 |
OC12CCC(C3=CC(=O)OC3)C1(CCC1([H])C3(CCCCC3([H])CCC21[H])C)C
|
|
| MCULE-1286702458 |
0.67 |
[C@@H]1(CCCCC)CC=CC(=O)O1
|
|
| MCULE-7555892876 |
0.67 |
O=C1OCC([C@@H]2[C@]3(C)[C@]([C@]4([C@@](CC3)([H])[C@]3(C)[C@](C[C@H](CC3)O)([H])CC4)[H])(O)CC2)=C1
|
|
| MCULE-7838361683 |
0.67 |
[C@H]1(CCCCC)CC=CC(=O)O1
|
|
| MCULE-2541512222 |
0.67 |
[C@]12(O)CC[C@@H]([C@@]1(C)CC[C@@]1([H])[C@@]2([H])CC[C@@]2([C@]1(C)CC[C@H](O)C2)[H])C1COC(=O)C=1
|
|
| MCULE-7772391429 |
0.67 |
[C@]12(C)CCC3[C@@]([H])(CCC4=CC(OC(C)=O)CC[C@]34C)C1CC[C@]12CCC(=O)O1
|
|
| MCULE-5985682586 |
0.67 |
C1C(O)C(C)(C)C2C(C(CC34OC3C(O)C(CO)=CC4O)C(=CC2)C)(C1)C
|
|
| MCULE-2591222806 |
0.67 |
C1CC(C)(C)C2C(C(CC34OC3C(O)C(CO)=CC4O)C(=CC2)C)(C1)C
|
|
| MCULE-2337967762 |
0.67 |
[C@]12(C)CCC3C(CCC4=CC(OC(C)=O)CC[C@]34C)C1CC[C@]2(OC(C)=O)C(C)OC(C)=O
|
|
| MCULE-1954640803 |
0.67 |
C(C)(=O)OC1CCC2(C)C3C(C4CCC(C(C=CCC(C)C)C)C4(C)CC=3)=CCC2(O)C1
|
|
| MCULE-1671560839 |
0.67 |
[C@@]12(CCC(C=C1CCC1C2CC[C@]2(C1CCC2C(C)=O)C)=O)COC(CCC(O)=O)=O
|
|
| MCULE-5727228686 |
0.67 |
C(C)(=O)OC1CCC2(C)C(C1)=CC=C1C3CCC(C(C)C=CC(C)C(C)C)C3(C)CC=C12
|
|
| MCULE-6095828735 |
0.67 |
C12C3C4C5C(C1C4C1CC(OC(C)=O)C(=O)C3=1)C1C(=O)C(OC(C)=O)CC=1C25
|
|
| MCULE-7034575967 |
0.67 |
[C@]12(C(C)(O)CC(OCC)=O)[C@H](O1)CC1C3C(CC[C@]21C)[C@@]1(C)CCC(CC1=CC3)OC(C)=O
|
|
| MCULE-8363142031 |
0.67 |
[C@]12(C)CCC3C(CC=C4CC(CC[C@]34C)OC(C)=O)C1C[C@@H](O)C2(OC)C(C)=NO
|
|
| MCULE-2203626367 |
0.67 |
C1(C)CC2OC(=O)C(=C)C2C(O)C=1C(C)CCCO
|
|
| MCULE-9089182234 |
0.67 |
C12(C)CCC(CC1=CCC1C2CCC2(C1CCC2=O)C)OC(=O)CC[NH+]1CCCC1
|
|
| MCULE-3253304767 |
0.67 |
[C@]12(C)CC[C@@H](CC1=CC[C@]1([H])[C@]2([H])CC[C@]2([C@@]1([H])CCC2=O)C)OC(=O)CCN1CCCC1
|
|
| MCULE-5231093187 |
0.67 |
[Cl-].C12(C)CCC3C(CC=C4CC(CCC34C)OC(=O)CC[NH+]3CCCCC3)C1CCC2C(C)CCCC(C)C
|
|
| MCULE-4115143726 |
0.67 |
O[C@@H]1C(=C(C)C[C@@]2([H])OC(=O)C(=C)[C@@]12[H])[C@@H](C)CCCO
|
|
| MCULE-7864191553 |
0.67 |
[C@H]12OC(=O)C(=C)[C@H]1[C@H](O)C([C@@H](C)CCCOC(=O)C)=C(C)C2
|
|
| MCULE-7240141445 |
0.67 |
[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-5708067201 |
0.67 |
C1[C@@](O)(C)[C@]2([H])[C@@]3([H])[C@H]4C=C(C)[C@@]5([C@H]6OC(=O)[C@@H](C)[C@@H]6CC[C@](C)(O)[C@@]54[H])[C@@]3([H])C(C)=C2[C@H]2OC(=O)[C@@H](C)[C@@H]2C1
|
|
| MCULE-2338427492 |
0.67 |
CC(CC1OCCC1)=CC(O)=O
|
|
| MCULE-7818588594 |
0.67 |
CCCCCC[C@@](O)(CC=CCCCCCCCC(OCC)=O)[H]
|
|
| MCULE-8750855908 |
0.67 |
C1[C@]([H])(C/C=C(\C)/CC2CC(C)C(=O)O2)C(C(O1)=O)=C
|
|
| MCULE-8805854090 |
0.67 |
[C@]12(C)CCC3C(CC=C4CC(O)CC[C@]34C)C1CCC2C(C)CCC(OC)=O
|
|
| MCULE-9450414421 |
0.67 |
C1(CCCCC1OC(C)=O)=CC(C)C
|
|
| MCULE-5362337107 |
0.67 |
C12(C)C(C(C)CCC(O)=O)CCC1C1C(CC2O)C2(C)CCC(CC2=CC1O)O
|
|
| MCULE-8753646114 |
0.67 |
[C@@]12(O)CC[C@H]([C@](O)(C)[C@H](O)C[C@H]3[C@H](C)C(=O)O[C@@H]3C)[C@@]1(C)CC[C@]1([H])[C@@]3(C)C[C@@H]([C@H](O)C[C@@]3([H])C(=O)C=C21)O
|
|
| MCULE-2562455528 |
0.67 |
C1(O)CC2C(C)(CCC3=CC(=O)OC3O)C(C)CCC32COC(=O)C3=C1
|
|
| MCULE-9966949324 |
0.67 |
[C@H]1(OC(=O)C)C[C@@]2([H])[C@H](C)CC(=O)[C@@H](C(C)C)[C@@]2([H])C=C1C
|
|
| MCULE-1374093397 |
0.67 |
C1=CC2CC1C1C(COC(=O)C)=CC12
|
|
| MCULE-8302542414 |
0.67 |
C(C)(=O)OC1CCC2(C)C(C1)(CC(C1C3CCC(C(C)C=CC(C)C(C)C)C3(C)CC(C2=1)=O)OC(C)=O)[H]
|
|
| MCULE-2247897001 |
0.67 |
COC(C1C2(C)C(C3C(CC2)C2(C)C(CC(CC2)O)=CC3)CC1)=O
|
|
| MCULE-2479536906 |
0.67 |
[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-9439877737 |
0.67 |
O1[C@H](C)[C@@H](C[C@@H](O)[C@](O)([C@@H]2[C@@]3(C)CC[C@]4([H])[C@]5(C)[C@]([H])(C(=O)C=C4[C@]3(O)CC2)C[C@@H](O)[C@@H](O)C5)C)[C@H](C)C1=O
|
|
| MCULE-5499634167 |
0.67 |
CC1C(=O)OC2C1CCC(O)(C)C1C2=C(C)C2C1C1C3C(O)(C)CCC4C(C)C(=O)OC4C23C(C)=C1
|
|
| MCULE-3716742475 |
0.67 |
[C@@H]1(C[C@@]2(C3CC[C@@]4([C@H](CC[C@]4(C3=CC([C@]2([H])C[C@H]1O)=O)O)[C@@]([C@H](O)C[C@@H]1[C@@H](C)OC(=O)[C@H]1C)(C)O)C)C)O
|
|
| MCULE-6932223026 |
0.67 |
C12(C)CCC3C(CC=C4CC(CCC34C)OC(C)=O)C1CC(C(C#N)C(N)=O)C2C(C)=O
|
|
| MCULE-6950544067 |
0.67 |
[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]
|
|
| MolPort-000-707-521 |
0.67 |
CC(C)\C=C1/CCCCC1OC(C)=O
|
|
| MolPort-000-823-748 |
0.67 |
COC(=O)CCC(C)C1CCC2C3CC=C4CC(O)CC[C@]4(C)C3CC[C@]12C
|
|
| MolPort-005-944-946 |
0.67 |
CC1CC(C\C(C)=C\C[C@H]2COC(=O)C2=C)OC1=O
|
|
| MolPort-001-741-220 |
0.67 |
C[C@H]1OC(=O)[C@@H](C)[C@@H]1C[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-002-506-876 |
0.67 |
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-004-781-058 |
0.67 |
CCOC(=O)C1CCCC=C1
|
|
| MolPort-002-511-796 |
0.67 |
COC(=O)C1CCC2C3CC=C4CC(O)CC[C@]4(C)C3CC[C@]12C
|
|
| MolPort-002-521-223 |
0.67 |
COC(=O)CC[C@@H](C)[C@H]1CCC2[C@@H]3CC=C4C[C@H](O)CC[C@]4(C)C3CC[C@]12C
|
|
| MolPort-002-799-473 |
0.67 |
CC(=O)OCC1CCCC2=C(C)C(=O)CCC12COC(C)=O
|
|
| MolPort-002-841-867 |
0.67 |
CC(C)CCCC(C)[C@H]1CCC2C3C(CC[C@]12C)[C@@]1(C)CCC(CC1=CC3=O)OC(C)(C)C
|
|
| MolPort-003-959-446 |
0.67 |
CCCCCC[C@@H](O)C\C=C/CCCCCCCC(=O)OCC
|
|
| MolPort-002-506-884 |
0.67 |
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-000-207-694 |
0.67 |
COC(=O)C1CCC2C3CC=C4CC(O)CCC4(C)C3CCC12C
|
|
| MolPort-046-690-131 |
0.67 |
[2H]C([2H])([2H])[C@@H](CC)C(=O)O[C@H]1CC=CC2=C[C@@H](O)[C@H](C)[C@H](CC[C@@H]3C[C@@H](O)CC(=O)O3)[C@@H]12
|
|
| MolPort-046-690-071 |
0.67 |
CC(=O)O[C@@]1(CC[C@H]2[C@@H]3C[C@](C)(O)C4=CC(=O)CC[C@]4(C)[C@H]3CC[C@]12C)C(C)=O
|
|
| MolPort-044-755-245 |
0.67 |
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-039-052-352 |
0.67 |
C[C@H]1OC(=O)[C@@H](C)C1C[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-046-762-479 |
0.67 |
CC(=O)O[C@@]1(CC[C@H]2[C@@H]3C[C@@](C)(O)C4=CC(=O)CC[C@]4(C)[C@H]3CC[C@]12C)C(C)=O
|
|
| MolPort-028-600-130 |
0.67 |
C[C@H]1[C@@H]2CC[C@](C)(O)[C@@H]3[C@H]4[C@H]5C=C(C)[C@@]6([C@H]7OC(=O)[C@@H](C)[C@@H]7CC[C@](C)(O)[C@H]56)[C@H]4C(C)=C3[C@H]2OC1=O
|
|
| MolPort-046-673-512 |
0.67 |
CCOC(=O)C1(C)CCCC=C1
|
|
| MolPort-044-559-975 |
0.67 |
C[C@H]1OC(=O)[C@@H](C)[C@@H]1C[C@@H](O)[C@](C)(O)[C@H]1CC[C@@]2(O)C3=CC(=O)[C@@H]4CC(O)C(O)CC4(C)[C@H]3CCC12C
|
|
| MolPort-039-338-335 |
0.67 |
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-019-937-189 |
0.67 |
CC(CCC1=C(C)C(=O)[C@@H](OC(C)=O)C2C(C)(C)CCC[C@]12C)CC(O)=O
|
|
| MolPort-035-706-205 |
0.67 |
CC(C)[C@H]1[C@H]2C=C(C)[C@H](C[C@H]2[C@H](C)CC1=O)OC(C)=O
|
|
| MolPort-021-804-692 |
0.67 |
CC1CCC23COC(=O)C2=CC(O)CC3C1(C)CCC1=CC(=O)OC1O
|
|
| MolPort-020-005-955 |
0.67 |
C[C@H]1OC(=O)[C@@H](C)[C@@H]1C[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-039-338-182 |
0.66 |
CC(=O)O[C@H]1C[C@@]2(O)[C@@H](OC(C)=O)[C@@H]3[C@@]4(CO4)[C@H](C[C@H](OC(C)=O)[C@@]3(C)[C@@H](OC(C)=O)[C@H](OC(C)=O)C(=C1C)C2(C)C)OC(C)=O
|
|
| MolPort-042-675-476 |
0.66 |
CC1CC2(OC(C)=O)C(\C=C(C)\C(O)CC3C(\C=C(C)\C2=O)C3(C)C)C1O
|
|
| MolPort-039-338-116 |
0.66 |
CC(=O)O[C@H]1C[C@@]2(OC(C)=O)[C@@H](OC(C)=O)[C@@H]3[C@@]4(CO4)[C@@H](O)C[C@H](OC(C)=O)[C@@]3(C)[C@@H](OC(C)=O)[C@H](OC(C)=O)C(=C1C)C2(C)C
|
|
| MolPort-009-758-477 |
0.66 |
Cl.C[C@]12CC[C@H]3[C@@H](CC=C4C[C@H](CC[C@]34C)OC(=O)CCN3CCCC3)[C@@H]1CCC2=O
|
|
| MolPort-000-743-180 |
0.66 |
[Cl-].CC12CCC3C(CC=C4CC(CCC34C)OC(=O)CC[NH+]3CCCC3)C1CCC2=O
|
|
| MolPort-003-849-961 |
0.66 |
[2H]C([2H])([2H])[C@@H](CC)C(=O)O[C@H]1C[C@H](O)C=C2C=C[C@H](C)[C@H](CC[C@@H]3C[C@@H](O)CC(=O)O3)[C@@H]12
|
|
| MolPort-003-849-960 |
0.66 |
CC[C@H](C)C(=O)O[C@H]1C[C@H](O)C=C2C=C[C@H](C)[C@H](CC[C@@H]3C[C@@H](O)CC(=O)O3)[C@@H]12
|
|
| MolPort-046-702-696 |
0.66 |
CCC(C)C(=O)OC1CC(O)C=C2C=CC(C)C(CCC3CC(O)CC(=O)O3)C12
|
|
| MolPort-003-850-249 |
0.66 |
[NH4+].CCC(C)(C)C(=O)O[C@H]1C[C@@H](C)C=C2C=C[C@H](C)[C@H](CC[C@@H](O)C[C@@H](O)CC([O-])=O)[C@@H]12
|
|
| MolPort-005-944-535 |
0.66 |
CCCCCC(=O)OC1C=C(CO)C(O)(CO)C2(C)C(O)CCC(C)(C)C12
|
|
| MolPort-038-386-565 |
0.66 |
CCCCCCCCCCCC(O)CC(O)CC(O)CC(O)CC1CC=CC(=O)O1
|
|
| MolPort-046-684-152 |
0.66 |
CC(C)[C@@]12CC[C@@](C)(O1)[C@H](CC\C(C)=C\CC\C(C)=C\C2)OC(C)=O
|
|
| MolPort-027-640-917 |
0.66 |
CCCCC[C@@H]1OC(=O)CCC\C=C/C[C@H]2[C@@H](O)C[C@@H](O)[C@@H]2\C=C\1
|
|
| MolPort-001-739-397 |
0.66 |
CCC(C)C(=O)O[C@H]1CCC=C2C=C[C@H](C)[C@H](CC[C@@H](O)C[C@@H](O)CC(O)=O)[C@@H]12
|
|
| MolPort-001-739-296 |
0.66 |
CCC(C)C(=O)OC1CC(C)C=C2C=CC(C)C(CCC(O)CC(O)CC(O)=O)C12
|
|
| MolPort-044-637-532 |
0.66 |
CC(C)C12CCC(C)(O1)C(CC\C(C)=C/CC\C(C)=C\C2)OC(C)=O
|
|
| MolPort-002-511-342 |
0.66 |
C[C@H]1CCC[C@]2(C)C[C@H]3OC(=O)C(=C)[C@H]3C=C12
|
|
| MolPort-020-005-743 |
0.66 |
CC(=O)OC(C)(C)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-019-931-744 |
0.66 |
CCCC(O)CC1CC(O)\C=C\C(O)C(O)C(C)(C)C(=O)O1
|
|
| MolPort-046-764-829 |
0.66 |
[NH4+].[2H]C([2H])([2H])C(CC)(C(=O)O[C@H]1C[C@@H](C)C=C2C=C[C@H](C)[C@H](CC[C@H](O)C[C@H](O)CC([O-])=O)[C@@H]12)C([2H])([2H])[2H]
|
|
| MolPort-020-005-696 |
0.66 |
C[C@@H]1CCC[C@@]2(C)C[C@@H]3OC(=O)C(=C)[C@@H]3C=C12
|
|
| MolPort-029-999-415 |
0.66 |
CC(=O)OC1CC[C@]2(C)C3CC[C@@]4(C)C(CC[C@]4(OC(C)=O)C(C)=O)C3CCC2=C1
|
|
| MolPort-005-944-539 |
0.66 |
CCCCCCCC(=O)OC1C=C(CO)C(O)(CO)C2(C)C(O)CCC(C)(C)C12
|
|
| MolPort-046-594-234 |
0.66 |
CC(=O)OC(C)(C)CCC(=O)C(C)(O)C1C(O)CC2(C)C3CC=C4C(CC(O)C(O)C4(C)C)C3(C)C(=O)CC12C
|
|
| MolPort-039-337-161 |
0.66 |
CC(=C)C(=O)O[C@H]1C[C@@]2(C)[C@H](O)CC=C(C)[C@@H]2[C@H]2OC(=O)C(=C)[C@H]12
|
|
| MolPort-021-804-680 |
0.66 |
CC(=O)OC1C(O)C(C)(O)C(\C=C\C(O)=O)C2(C)CCCC(C)(C)C12
|
|
| MolPort-044-811-197 |
0.66 |
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)(COC(C)=O)C=C4C=O
|
|
| MolPort-002-509-690 |
0.66 |
CC(=O)O[C@H]1CC[C@]2(C)C3CC[C@@]4(C)C(CC[C@]4(OC(C)=O)C(C)=O)[C@@H]3CCC2=C1
|
|
| MolPort-001-942-709 |
0.66 |
CC1CCCC2(C)CC3OC(=O)C(=C)C3C=C12
|
|
| MolPort-023-220-532 |
0.66 |
N.CCC(C)(C)C(=O)O[C@H]1C[C@@H](C)C=C2C=C[C@H](C)[C@H](CC[C@@H](O)C[C@@H](O)CC(O)=O)[C@@H]12
|
|
| MolPort-044-724-000 |
0.66 |
[NH4+].CCC(C)(C)C(=O)O[C@@H]1C[C@H](C)C=C2C=C[C@@H](C)[C@@H](CC[C@@H](O)C[C@H]([O-])CC(O)=O)[C@H]12
|
|
| MolPort-044-754-178 |
0.66 |
CC(C)[C@]12CC[C@@](C)(O1)[C@@H](CC\C(C)=C\CC\C(C)=C/C2)OC(C)=O
|
|
| MolPort-044-559-903 |
0.66 |
CC1=C2CC[C@@](C)(O)[C@@H]2[C@H]2OC(=O)C(=C)[C@@H]2CC1
|
|
| MolPort-010-969-350 |
0.66 |
CC1CCC[C@]2(C)CC3OC(=O)C(=C)C3C=C12
|
|
| MolPort-003-724-684 |
0.66 |
CC12CCC3C(CCC4(O)CC(O)CCC34CO)C1(O)CCC2C1=CC(=O)OC1
|
|
| MolPort-002-507-211 |
0.66 |
C[C@@]12[C@H](CC[C@]1(O)[C@@H]1CCC3C[C@@H](O)CC[C@]3(C)C1C[C@H]2O)C1=CC(=O)OC1
|
|
| MolPort-002-507-406 |
0.66 |
C[C@]12CCC3C(CC[C@]4(O)C[C@@H](O)CC[C@]34CO)[C@@]1(O)CC[C@@H]2C1=CC(=O)OC1
|
|
| MolPort-002-526-653 |
0.66 |
C[C@]12CC[C@H]3[C@@H](CC[C@]4(O)C[C@@H](O)CC[C@]34CO)[C@@]1(O)CC[C@@H]2C1=CC(=O)OC1
|
|
| MolPort-002-508-311 |
0.66 |
C[C@]12CC[C@H]3[C@@H](CC[C@]4(O)C[C@@H](O)CC[C@]34C)[C@@]1(O)CC[C@@H]2C1=CC(=O)OC1
|
|
| MolPort-020-005-825 |
0.66 |
CCCCC[C@](C)(O)\C=C\[C@H]1[C@H](O)C[C@H](O)[C@@H]1C\C=C/CCCC(=O)OC
|
|
| MolPort-027-640-907 |
0.66 |
CCCCC[C@H](O)\C=C\[C@H]1[C@H](O)C[C@H](O)[C@@H]1C\C=C/CCCC(=O)OC
|
|
| MolPort-006-069-345 |
0.66 |
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-003-666-004 |
0.66 |
CC12C(CCC1(O)C1CCC3CC(O)CCC3(C)C1CC2O)C1=CC(=O)OC1
|
|
| MolPort-004-955-165 |
0.66 |
C[C@@]12[C@H](CC[C@]1(O)[C@@H]1CC[C@@H]3C[C@@H](O)CC[C@]3(C)[C@H]1C[C@H]2O)C1=CC(=O)OC1
|
|
| MolPort-039-338-147 |
0.66 |
C[C@]12CC[C@@H]3[C@@]4(C)CC[C@H](O)C[C@H]4CC[C@@]3(O)[C@@]1(O)CC[C@@H]2C1=CC(=O)OC1
|
|
| MolPort-007-549-369 |
0.66 |
CC12C(CCC1(O)C1CCC3CC(O)CCC3(C)[C@H]1CC2O)C1=CC(=O)OC1
|
|
| MolPort-027-640-943 |
0.66 |
CCCCC[C@@](C)(O)\C=C\[C@H]1[C@H](O)C[C@H](O)[C@@H]1C\C=C/CCCC(=O)OC
|
|
| MolPort-046-153-715 |
0.66 |
C[C@]12CC[C@H]3[C@@H](CC[C@H]4C[C@@H](O)CC[C@]34C)C1=CC[C@@H]2C1=CC(=O)OC1
|
|
| MolPort-044-562-376 |
0.66 |
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-007-549-410 |
0.66 |
CC12CC[C@H]3[C@@H](CCC4(O)CC(O)CCC34CO)C1(O)CCC2C1=CC(=O)OC1
|
|
| MolPort-002-509-108 |
0.66 |
C[C@@]12[C@H](CC[C@]1(O)[C@@H]1CC[C@@H]3C[C@@H](O)CC[C@]3(C)[C@H]1CC2O)C1=CC(=O)OC1
|
|
| MolPort-039-052-455 |
0.66 |
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-039-338-184 |
0.66 |
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
|
|
| MCULE-5326752011 |
0.66 |
[C@@]12(CO1)[C@@H](OC(C)=O)C[C@H](OC(C)=O)[C@@]1(C)[C@@H](OC(C)=O)[C@@H](C3=C(C)[C@@H](OC(C)=O)C[C@](O)(C3(C)C)[C@@H](OC(C)=O)[C@@]12[H])OC(C)=O
|
|
| MCULE-8663661247 |
0.66 |
C12C=C(C)C(O)CC3C(C)(C)C3C=C(C)C(=O)C1(OC(C)=O)CC(C)C2O
|
|
| MCULE-6172158618 |
0.66 |
C12(C)CCC(CC1=CCC1C2CCC2(C1CCC2=O)C)OC(=O)CC[NH+]1CCCC1.[Cl-]
|
|
| MCULE-5079645096 |
0.66 |
Cl.[C@]12(C)CC[C@@H](CC1=CC[C@]1([H])[C@]2([H])CC[C@]2([C@@]1([H])CCC2=O)C)OC(=O)CCN1CCCC1
|
|
| MCULE-2972497233 |
0.66 |
C1CC2(C)C3C(=O)CC4(C)C(C5(CO)OC(=O)CC5)CC(O)C4(C)C=3C(O)CC2C(C)(C)C1=O
|
|
| MCULE-1713731192 |
0.66 |
C1CC(C)(C)C2C(C(CO)(C(=CC2OC(CCCCC)=O)CO)O)(C1O)C
|
|
| MCULE-3343469308 |
0.66 |
C1[C@@H](O)[C@]2(C)C[C@H](OC(=O)C(C)=C)[C@H]3C(=C)C(=O)O[C@@H]3[C@@]2([H])C(C)=C1
|
|
| MCULE-5288653087 |
0.66 |
C1C(C2(C(C(C=C(C2(O)CO)CO)OC(CCCCCCC)=O)C(C)(C)C1)C)O
|
|
| MCULE-3608909089 |
0.66 |
O(C(C(C)(C)CC)=O)[C@H]1C[C@@H](C)C=C2C=C[C@H](C)[C@H](CC[C@H](C[C@H](CC(=O)O)O)O)[C@@H]12
|
|
| MCULE-2901288503 |
0.66 |
C1(=O)C(=C)[C@]2([H])CCC(C)=C3CC[C@@](C)(O)[C@]3([H])[C@@]2([H])O1
|
|
| MCULE-8583685611 |
0.66 |
C1[C@H](OC(C(CC)C)=O)[C@@]2([H])C(C=C[C@H](C)[C@@H]2CC[C@@H](O)C[C@@H](O)CC(=O)O)=CC1
|
|
| MCULE-7414282746 |
0.66 |
C(=O)(C(C)CC)OC1CC(C)C=C2C=CC(C)C(CCC(O)CC(O)CC(=O)O)C12
|
|
| MCULE-2588682863 |
0.66 |
C1C(OC(=O)C(C)(C)C(C(O)C=CC1O)O)CC(CCC)O
|
|
| MCULE-7361919999 |
0.66 |
O1C(=O)C(=C)[C@]2([H])CCC(C)=C3[C@@]([H])([C@@]12[H])[C@@](O)(C)CC3
|
|
| MCULE-4106244241 |
0.66 |
[C@]12([H])C(C=C[C@H](C)[C@@H]1CC[C@@H](O)C[C@@H](O)CC([O-])=O)=C[C@H](C)C[C@@H]2OC(=O)[C@@H](C)CC
|
|
| MCULE-3110080775 |
0.66 |
C1(C)=CCC2(O[C@](C)(CC2)[C@H](OC(=O)C)CCC(C)=CCC1)C(C)C
|
|
| MCULE-1183269623 |
0.66 |
C1(C)CCC(C2(C)OC(CC2)(C(C)C)CC=C(C)CCC=1)OC(C)=O
|
|
| MCULE-1216188840 |
0.66 |
C(C)(=O)OC1CCC2(C)C3CCC4(C)C(C(C)CCCC(C)C)CCC4C3CC(C2=C1)=O
|
|
| MCULE-4138416849 |
0.66 |
C(C)(=O)OC1CCC2(C)C(O)(C1)CC=C1C3CCC(C(C)C=CC(C)C(C)C)C3(C)CC(C21)=O
|
|
| MCULE-4466026241 |
0.66 |
C[C@@]12O[C@@](C(C)C)(CC=C(CCC=C(CC[C@H]1OC(=O)C)C)C)CC2
|
|
| MCULE-9824682578 |
0.66 |
[C@@]12(C)C[C@H]([C@]([H])([C@@](C)(O)C(CCC(C)(C)OC(C)=O)=O)[C@@]1(C)CC(=O)[C@@]1(C)[C@]3(C(C(C)(C)[C@@H]([C@@H](O)C3)O)=CC[C@]12[H])[H])O
|
|
| MCULE-1819290201 |
0.66 |
[C@]12(C)CCC3[C@@]([H])(CCC4=C[C@@H](OC(C)=O)CC[C@]34C)C1CC[C@@]2(C(C)=O)OC(C)=O
|
|
| MCULE-3702699592 |
0.66 |
C1CC2(C)C(/C=C/C(=O)O)C(O)(C)C(O)C(OC(C)=O)C2C(C)(C)C1
|
|
| MCULE-2182894320 |
0.66 |
CC(OC(CCC(C(O)(C1C2(C)CC(C3(C)C4CC(O)C(O)C(C)(C)C4=CCC3C2(C)CC1O)=O)C)=O)(C)C)=O
|
|
| MCULE-5993142660 |
0.66 |
C12(O)CCC(C3COC(=O)C=3)C1(C)C(O)CC1C3(C(CC(CC3)O)CCC12)C
|
|
| MCULE-3919630131 |
0.66 |
O=C1C=C(CO1)C1CCC2(O)C1(C)CC(O)C1C2CCC2CC(O)CCC21C
|
|
| MCULE-7243993523 |
0.66 |
[C@]12(O)CC[C@@H]([C@@]1(C)CCC1C2CC[C@]2([C@]1(CO)CC[C@H](O)C2)O)C1COC(=O)C=1
|
|
| MCULE-5234178765 |
0.66 |
C1C[C@]2(C)[C@@]3([H])CC[C@]4(C)[C@@]([H])(C5COC(=O)C=5)CC=C4[C@]3([H])CC[C@@]2([H])C[C@H]1O
|
|
| MCULE-2818532213 |
0.66 |
[C@]12(O)CC[C@@H]([C@@]1(C)CC[C@@]1([H])[C@@]2([H])CC[C@]2([C@]1(C)CC[C@H](O)C2)O)C1COC(=O)C=1
|
|
| MCULE-4697381379 |
0.66 |
C12(O)CCC(C1(C)CCC1C2CCC2(C1(CO)CCC(O)C2)O)C1COC(=O)C=1
|
|
| MCULE-8328775128 |
0.66 |
C1C[C@]2(C)[C@@]3([H])C[C@@H](O)[C@]4(C)[C@](C5=CC(=O)OC5)([H])CC[C@]4(O)[C@]3([H])CC[C@]2([H])C[C@H]1O
|
|
| MCULE-5598679764 |
0.66 |
O=C1C=C(CO1)C1CCC2(O)C1(C)CCC1C2CCC2(O)CC(O)CCC21C
|
|
| MCULE-2575982393 |
0.66 |
C1C[C@]2(C)[C@@]3([H])CC[C@]4(C)[C@@]([H])(C5COC(=O)C=5)CC[C@]4(O)[C@]3([H])CC[C@]2(O)C[C@H]1O
|
|
| MCULE-4097681428 |
0.66 |
[C@@H]1(O)C[C@]2([H])[C@](C)(CC1)[C@]1([H])[C@]([H])([C@]3(O)[C@@]([C@H](O)C1)(C)[C@@H](C1=CC(=O)OC1)CC3)CC2
|
|
| MCULE-5124685906 |
0.66 |
C1C[C@]2(C)[C@@]3([H])CC[C@]4(C)[C@@]([H])(C5COC(=O)C=5)CC[C@]4(O)[C@]3(O)CC[C@]2([H])C[C@H]1O
|
|
| MCULE-8274191901 |
0.66 |
[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-7772727437 |
0.66 |
C(C)(=O)OC1CCC2(C)C(C1)(CCC1C3CCC(C(C)C=CC(C)C(C)C)C3(C)CC(C2=1)=O)[H]
|
|
| MCULE-9960917770 |
0.66 |
[C@H]1(/C=C/[C@](O)(C)CCCCC)[C@H](O)C[C@H](O)[C@@H]1C/C=C\CCCC(=O)OC
|
|
| MCULE-8924549531 |
0.66 |
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-8982382729 |
0.66 |
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]
|
|