| MCULE-2598263714 |
1 |
C1[C@@H](O)[C@]2(C)CC[C@@H](C(C)C)[C@H](O)[C@@]2([H])C(=C)C1
|
|
| MolPort-035-706-227 |
1 |
CC(C)[C@@H]1CC[C@@]2(C)[C@H](O)CCC(=C)[C@@H]2[C@H]1O
|
|
| MCULE-3637458682 |
0.91 |
C1CC(O)(C2C(=C)C2)CCC1
|
|
| MCULE-6951581773 |
0.91 |
CCC(CC1C(O)(C)CCCC1)=C
|
|
| MCULE-5148579161 |
0.91 |
CC(C[C@H]1[C@@](O)(C)CCCC1)=C
|
|
| MCULE-5841352334 |
0.91 |
C1(CCO)C(=C)CCCC1C
|
|
| MCULE-2322169644 |
0.91 |
CC(CC1C(O)(C)CCCC1)=C
|
|
| MCULE-1023726917 |
0.91 |
C[C@@]1([C@H](CC=C)CCCC1)O
|
|
| MCULE-2632884278 |
0.91 |
CC1(C(CC=C)CCCC1)O
|
|
| MCULE-4556255500 |
0.91 |
CCC(C[C@H]1[C@@](O)(C)CCCC1)=C
|
|
| MCULE-2678449677 |
0.91 |
C1(O)(CC=C)CCCCC1
|
|
| MCULE-2425830614 |
0.91 |
C1(C)(O)C(C)CCC(C(C)=C)C1
|
|
| MCULE-2035256108 |
0.91 |
C1C[C@]2(C)[C@@]3([H])CC[C@@](C=C)(C)C[C@]3(O)CC[C@@]2([H])[C@](C)(CO)C1
|
|
| MolPort-044-624-388 |
0.91 |
OCC1(CC=C)CCCCC1
|
|
| MolPort-003-932-880 |
0.91 |
C[C@H]1CC[C@@H]([C@@H](O)C1)C(C)=C
|
|
| MolPort-039-338-367 |
0.91 |
C[C@@]1(CC[C@@H]2[C@@]3(C)CCC[C@@](C)(CO)[C@@H]3CC[C@@]2(O)C1)C=C
|
|
| MolPort-046-008-744 |
0.91 |
OC1CCCCC1C=C
|
|
| MolPort-038-387-157 |
0.91 |
O[C@@H]1CCCC[C@H]1CC=C
|
|
| MolPort-003-895-936 |
0.91 |
C[C@@H]1CC[C@H]([C@H](O)C1)C(C)=C
|
|
| MolPort-001-782-935 |
0.91 |
OC1CCCCC1CC=C
|
|
| MolPort-002-510-257 |
0.91 |
CC1CCC(C(O)C1)C(C)=C
|
|
| MolPort-028-951-588 |
0.91 |
CC(O)(CC=C)C1CCCCC1
|
|
| MCULE-6745205544 |
0.88 |
C1C[C@]2(C)[C@@]3([H])CC[C@]4([H])[C@]5(CC[C@H](C(=C)C)[C@]5([H])CC[C@@]4(C)[C@]3(C)C[C@@H](O)[C@@]2([H])C(=C)[C@H]1O)C
|
|
| MolPort-039-338-299 |
0.88 |
CC(=C)[C@H]1CC[C@@]2(C)[C@H]1CC[C@]1(C)[C@@H]2CC[C@@H]2[C@@]3(C)CC[C@H](O)C(=C)[C@@H]3[C@H](O)C[C@@]12C
|
|
| MCULE-1732269970 |
0.87 |
C1(=C)C(CO)CC2CC1C2(C)C
|
|
| MCULE-3157102298 |
0.87 |
OC1(C(C2CC2)CCCC1)CC=C
|
|
| MCULE-8428573714 |
0.87 |
OC1(CCC2(CC2)CC1)CCC=C
|
|
| MCULE-2796363664 |
0.87 |
C12(C)CCC(CC1(CC=C)O)C2(C)C
|
|
| MCULE-3324498456 |
0.87 |
OC1(CCC2(CC2)CC1)CC=C
|
|
| MCULE-2255820378 |
0.87 |
OC(C1CCC2(CC2)CC1)CC=C
|
|
| MCULE-4545573353 |
0.87 |
OC1(C2(CCCCC2)CC1)CCC=C
|
|
| MCULE-1535767582 |
0.87 |
OC1(C2(CCCCC2)CC1)CC=C
|
|
| MolPort-046-158-412 |
0.87 |
CC(C)(O)[C@@H]1CC[C@@]2(C)[C@H](O)CCC(=C)[C@@H]2C1
|
|
| MolPort-046-153-158 |
0.87 |
CC(=C)C1CCC2(C)C(O)CCC(C)(O)C2C1
|
|
| MolPort-001-740-488 |
0.87 |
CC(C)(O)[C@@H]1CC[C@@]2(C)C[C@@H](O)CC(=C)C2C1
|
|
| MolPort-002-729-398 |
0.87 |
CC1(C)C2CCC1(C)C(O)(CC=C)C2
|
|
| MolPort-006-135-500 |
0.86 |
CCC(=C)CCC(C)(O)CC
|
|
| MolPort-006-111-540 |
0.86 |
CC1(C)[C@@H](O)CC[C@]2(C)[C@@H](CC[C@H]3C(=C)CC[C@H]4C(C)(C)[C@@H](O)CC[C@]34C)C(=C)CC[C@@H]12
|
|
| MolPort-027-853-629 |
0.86 |
CC(CCO)CCC1C(=C)CCC2C(C)(C)C(O)CCC12C
|
|
| MolPort-027-835-585 |
0.86 |
C[C@H]1[C@@H]2[C@H]3CC[C@@H]4[C@@]5(C)CC[C@H](O)C(C)(C)[C@@H]5CC[C@@]4(C)[C@]3(C)CC[C@@]2(C)CCC1=C
|
|
| MolPort-001-792-282 |
0.86 |
CCCCCC(O)CC=C
|
|
| MCULE-4277793393 |
0.86 |
C1C[C@]2(C)[C@@H](CC[C@@H]3[C@@]4(C)CC[C@H](O)C(C)(C)[C@]4([H])CCC3=C)C(=C)CC[C@@]2([H])C(C)(C)[C@H]1O
|
|
| MolPort-035-706-275 |
0.83 |
CC(C)[C@@H](O)[C@H]1CC[C@]2(C)[C@@H]1C(=C)CC[C@H]2O
|
|
| MolPort-001-981-673 |
0.83 |
CC(O)(CC1C(C)(O)CCC2C(C)(C)CCCC12C)C=C
|
|
| MolPort-039-342-455 |
0.83 |
CC(O)(CCC1C(=C)CC(O)C2C(C)(C)CCCC12C)C=C
|
|
| MolPort-039-052-499 |
0.83 |
CC(=C)[C@@H]1CC[C@@](C)(O)[C@@H](O)C1
|
|
| MolPort-005-911-223 |
0.83 |
CC(O)(CC1[C@@](C)(O)CCC2C(C)(C)CCC[C@]12C)C=C
|
|
| MolPort-046-690-451 |
0.83 |
CC(=C)[C@@H]1CCC(=C)C(O)C1
|
|
| MolPort-046-153-724 |
0.83 |
CC(C)[C@@H]1CCC(=C)[C@@H]2CC[C@](C)(O)[C@@H](O)[C@@H]12
|
|
| MolPort-035-706-276 |
0.83 |
CC(=C)C[C@H]1CC[C@]2(C)[C@@H]1C(=C)CC[C@H]2O
|
|
| MCULE-4202024247 |
0.83 |
C1(O)C(CC(C)(O)C)C(C=C)CC1
|
|
| MCULE-6380276570 |
0.83 |
OC1(CC2CC(CC2)C1)CC=C
|
|
| MCULE-7124383227 |
0.83 |
C1[C@](O)(C)[C@@H](O)C[C@H](C(C)=C)C1
|
|
| MCULE-8721262408 |
0.83 |
C12(C)CCCC(C)(C)C1C(CC(=C)C2CCC(C)(O)C=C)O
|
|
| MCULE-6489336257 |
0.83 |
OC1(CC2CC(CC2)C1)CCC=C
|
|
| MCULE-9485824567 |
0.83 |
C1[C@@H](O)[C@]2(C)CC[C@]([H])([C@H](O)C(C)C)[C@@]2([H])C(=C)C1
|
|
| MCULE-4490847411 |
0.83 |
OC(C12CCCCC1C2)CC=C
|
|
| MCULE-4612736693 |
0.83 |
C1C[C@@]2([H])C(=C)CC[C@@H](C(C)C)[C@]2([H])[C@H](O)[C@@]1(C)O
|
|
| MCULE-1618072645 |
0.83 |
C12(C)CCCC(C)(C)C1CCC(C)(O)C2CC(C)(O)C=C
|
|
| MCULE-1546851504 |
0.83 |
C1[C@@H](O)[C@]2(C)CC[C@]([H])(CC(C)=C)[C@@]2([H])C(=C)C1
|
|
| MCULE-2418278489 |
0.83 |
OC(C1CC2C(C2)CC1)CC=C
|
|
| MCULE-2538841501 |
0.83 |
C12(C(C)O)CCC(C(=C)C1(C)C)C2
|
|
| MCULE-7729149940 |
0.83 |
OC(C1C2C(C2)CCC1)CC=C
|
|
| MCULE-4538160194 |
0.83 |
OC(C12CCCC1C2)CC=C
|
|
| MCULE-2306445220 |
0.83 |
C1(O)(C=C)C(C)CCC(C(C)C)C1
|
|
| MCULE-7379269815 |
0.83 |
CC1(C(CCC=C)CCCC1)O
|
|
| MCULE-1146015085 |
0.83 |
OC(C1CC2(CCC2)C1)CC=C
|
|
| MCULE-8867269901 |
0.83 |
CCC1C(CC=C)(O)CCCCC1
|
|
| MCULE-7834366617 |
0.83 |
CC(CCC1C(O)(C)CCCC1)=C
|
|
| MCULE-9042320602 |
0.83 |
OC(C1C2(CC2)C1)CC=C
|
|
| MCULE-5310074418 |
0.83 |
CC1([C@@]2([H])[C@]([C@@]3([C@](CC2)(C)[C@]2([C@]([C@@]4([C@](CC2)(C)CC[C@H]4C(=C)C)[H])([H])CC3)C)[H])(C)CC[C@@H]1O)C
|
|
| MCULE-1451020763 |
0.83 |
CC(CC(C1CC2(CCC2)C1)O)=C
|
|
| MCULE-5317851297 |
0.83 |
CC(C1C(CC=C)(O)CCCCC1)C
|
|
| MCULE-7409280646 |
0.83 |
CC1C(C)(C)C(C(CC=C)O)(C)CC1
|
|
| MCULE-8635473086 |
0.83 |
C(O)(CC=C)(CC=C)CCCCCCCCCCCCCCCCCCCCC
|
|
| MCULE-5964566264 |
0.83 |
CC(CC[C@H]1[C@@](O)(C)CCCC1)=C
|
|
| MCULE-5388707513 |
0.83 |
OCC1(CC2(CCC2)C1)CC=C
|
|
| MCULE-2562807594 |
0.83 |
C[C@@]1([C@H](CCC=C)CCCC1)O
|
|
| MCULE-5014251892 |
0.83 |
CC(C=C)(CC1CCCCC1)O
|
|
| MCULE-6234017937 |
0.83 |
CC(C(CC1CCCCC1)(O)C)=C
|
|
| MCULE-1457963521 |
0.83 |
C12CC[C@@]3([H])CCC(=C)CC3(C)C1CCC1(C)[C@](CCC21)(O)C
|
|
| MCULE-6674525093 |
0.83 |
[C@@]12(C)CCC3(C(C(CC3)C(C)=C)C1CCC1[C@@]2(C)CCC2C1(C)CCC(O)C2(C)C)C
|
|
| MCULE-2551726771 |
0.83 |
C12CC[C@@]3(C)CCC(=C)CC3(C)C1CCC1(C)C(CCC21)C(O)C
|
|
| MCULE-7927989762 |
0.83 |
C1(=C)C2CCCC1CC(CO)C2
|
|
| MCULE-8763812176 |
0.83 |
[C@]12([H])[C@H](C(C)=C)CC[C@]1(C)CC[C@]1(C)[C@]2([H])CC[C@]2([H])[C@@]3(C)CC[C@H](O)C(C)(C)[C@]3([H])CC[C@@]12C
|
|
| MCULE-7120659957 |
0.83 |
C1CC2(C)C(CCC(O)(C=C)C)CCCC2C(C)(C)C1
|
|
| MCULE-2601149580 |
0.83 |
CC1C(CC=C)(O)CCCCC1
|
|
| MCULE-7513685245 |
0.83 |
CC1C(CCC=C)(O)CCCCC1
|
|
| MolPort-006-111-741 |
0.83 |
CC(=C)[C@@H]1CC[C@]2(C)CC[C@]3(C)[C@H](CC[C@@H]4[C@@]5(C)CC[C@H](O)C(C)(C)[C@@H]5CC[C@@]34C)[C@@H]12
|
|
| MolPort-007-980-882 |
0.83 |
CC(=C)[C@@H]1CCC2(C)CC[C@]3(C)C(CCC4[C@@]5(C)CCC(O)C(C)(C)C5CC[C@@]34C)C12
|
|
| MolPort-003-936-684 |
0.83 |
OC1(CCCCC1)C=C
|
|
| MolPort-009-194-534 |
0.83 |
OCC1CCC(=C)CC1
|
|
| MolPort-003-927-230 |
0.83 |
CC(C)(O)[C@@H]1CC[C@@]2(C)CCCC(=C)[C@@H]2C1
|
|
| MolPort-001-742-380 |
0.83 |
CC(=C)[C@@H]1CC[C@]2(C)CC[C@]3(C)[C@H](CC[C@@H]4[C@@]5(C)CC[C@@H](O)C(C)(C)[C@@H]5CC[C@@]34C)[C@@H]12
|
|
| MolPort-002-911-163 |
0.83 |
CC(O)C1CCC2C3CC[C@@]4(C)CCC(=C)CC4(C)C3CCC12C
|
|
| MolPort-002-911-160 |
0.83 |
C[C@]1(O)CCC2C3CC[C@H]4CCC(=C)CC4(C)C3CCC12C
|
|
| MolPort-001-742-379 |
0.83 |
CC(=C)[C@@H]1CC[C@]2(C)CC[C@]3(C)C(CCC4[C@@]5(C)CC[C@H](O)C(C)(C)C5CC[C@@]34C)C12
|
|
| MolPort-000-738-377 |
0.83 |
CC(=C)C1CCC2(C)CC[C@]3(C)C(CCC4C5(C)CCC(O)C(C)(C)C5CC[C@@]34C)C12
|
|
| MolPort-046-008-579 |
0.83 |
O[C@@H]1CCC[C@H]1CC=C
|
|
| MolPort-002-525-934 |
0.83 |
CC(=C)[C@@H]1CC[C@]2(C)CC[C@]3(C)[C@H](CCC4[C@@]5(C)CC[C@H](O)C(C)(C)C5CC[C@@]34C)C12
|
|
| MolPort-044-198-582 |
0.83 |
OCC1(CC=C)CCCC1
|
|
| MCULE-2133258179 |
0.82 |
C=C(CCC(O)CCC(=C)C)C
|
|
| MolPort-028-750-958 |
0.82 |
OCCCCCCCC=C
|
|
| MolPort-027-731-222 |
0.82 |
CCCCC(O)CC=C
|
|
| MolPort-006-120-143 |
0.82 |
OCCCCCCC=C
|
|
| MolPort-001-792-059 |
0.82 |
CC(CCCC(C)(C)O)C=C
|
|
| MolPort-001-760-000 |
0.82 |
OCCCCCCCCCC=C
|
|
| MolPort-001-769-701 |
0.82 |
OCCCCCCCCC=C
|
|
| MolPort-021-498-650 |
0.82 |
CC(O)CC(C)CCC=C
|
|
| MolPort-042-681-652 |
0.82 |
C[C@@H](O)CCCCCCC=C
|
|
| MolPort-021-072-420 |
0.82 |
CC(O)C(C)CCCC=C
|
|
| MolPort-044-637-440 |
0.81 |
CC(C)[C@@H]1CC[C@@]2(CO)[C@@H]3[C@@H](O)[C@@H](O)[C@@H]([C@H]13)C2=C
|
|
| MCULE-6486798788 |
0.81 |
C1(=C)[C@@]2([H])[C@H](O)[C@@H]([C@@]3([C@@]2([H])[C@@H](CC[C@]13CO)C(C)C)[H])O
|
|
| MCULE-9694440054 |
0.81 |
C1CC2(C)C(CC(O)C(O)(C)C=C)C(O)(C)C(O)C(O)C2C(C)(C)C1
|
|
| MolPort-021-804-679 |
0.81 |
CC(O)(C=C)C(O)CC1C(C)(O)C(O)C(O)C2C(C)(C)CCCC12C
|
|
| MCULE-4082238737 |
0.80 |
C1(O)C2(C)C3(C)C(C1C(=C)CC2)(C)CCC3
|
|
| MCULE-2545758328 |
0.80 |
[C@H]1(O)[C@H](O)C[C@@H](CO)[C@]2(CC[C@@]([H])(C(=C)C)C2)[C@@H]1C
|
|
| MCULE-1847652658 |
0.80 |
C1C[C@@]2([H])[C@](C)(O)CC[C@@H](C(C)C)[C@]2(O)CC1=C
|
|
| MolPort-035-706-210 |
0.80 |
CC(C)[C@@H]1CC[C@@](C)(O)[C@@H]2CCC(=C)C[C@@]12O
|
|
| MolPort-000-165-424 |
0.80 |
C[C@]12C[C@H](O)CC(CO)(CO)C1CCC13CC(CCC21)C(=C)C3
|
|
| MolPort-039-141-892 |
0.80 |
C[C@@H]1[C@@H](O)[C@H](O)C[C@@H](CO)[C@]11CC[C@H](C1)C(C)=C
|
|
| MolPort-039-052-485 |
0.80 |
CC(C)(O)C(O)CCC(=C)[C@H]1CC[C@]2(C)[C@@H]1CC[C@@H]1[C@@]3(C)CC[C@H](O)C(C)(C)[C@@H]3CC[C@@]21C
|
|
| MolPort-002-507-239 |
0.79 |
CC(=C)[C@@H]1CC[C@]2(CO)CC[C@]3(C)[C@H](CCC4[C@@]5(C)CC[C@H](O)C(C)(C)C5CC[C@@]34C)[C@@H]12
|
|
| MolPort-002-527-229 |
0.79 |
C[C@](O)(CC[C@H]1[C@](C)(O)CC[C@H]2C(C)(C)CCC[C@]12C)C=C
|
|
| MolPort-039-052-492 |
0.79 |
CC(=C)[C@@H]1CC[C@]2(C)CC[C@]3(C)[C@H](CC[C@@H]4[C@@]5(C)CC[C@@H](O)[C@@](C)(CO)[C@@H]5CC[C@@]34C)[C@@H]12
|
|
| MolPort-002-525-311 |
0.79 |
CC1(C)[C@H]2C[C@@H]1C(=C)[C@H](O)C2
|
|
| MolPort-039-052-694 |
0.79 |
CC(=C)[C@@H]1CC[C@]2(C)CC[C@]3(C)[C@H](CC[C@@H]4[C@@]5(C)C[C@@H](O)[C@H](O)C(C)(C)[C@@H]5CC[C@@]34C)[C@@H]12
|
|
| MolPort-039-338-212 |
0.79 |
C[C@](O)(CC[C@H]1C(=C)CC[C@H]2C(C)(C)CCC[C@]12C)C=C
|
|
| MolPort-039-142-052 |
0.79 |
C[C@]12CC[C@H]([C@@H]1[C@H]1CC[C@@H]3[C@@]4(C)CC[C@H](O)C(C)(C)[C@@H]4CC[C@@]3(C)[C@]1(C)CC2)C(=C)CO
|
|
| MolPort-000-703-193 |
0.79 |
CC1(C)CCC[C@]2(C)C(CCC(=C)C=C)C(C)(O)CCC12
|
|
| MolPort-002-524-880 |
0.79 |
CC(=C)[C@@H]1CC[C@]2(CO)CC[C@]3(C)[C@H](CCC4[C@@]5(C)CC[C@@H](O)C(C)(C)C5CC[C@@]34C)C12
|
|
| MolPort-042-675-344 |
0.79 |
CCCCCC(CCCC(=C)C(O)CO)C(C)C
|
|
| MolPort-002-524-392 |
0.79 |
CC1(C)CCC[C@]2(C)[C@@H](CCC(=C)C=C)[C@](C)(O)CC[C@@H]12
|
|
| MolPort-002-512-344 |
0.79 |
CC(=C)[C@@H]1CC[C@]2(CO)CC[C@]3(C)[C@H](CCC4[C@@]5(C)CCC(O)C(C)(C)C5CC[C@@]34C)C12
|
|
| MolPort-000-714-517 |
0.79 |
CC(=C)C1CCC2(CO)CC[C@]3(C)C(CCC4C5(C)CCC(O)C(C)(C)C5CC[C@@]34C)C12
|
|
| MolPort-002-528-182 |
0.79 |
C[C@](O)(CCC1[C@](C)(O)CCC2C(C)(C)CCC[C@]12C)C=C
|
|
| MolPort-019-936-840 |
0.79 |
OCC(O)CC(O)CCCCCCCCCCCCCCC=C
|
|
| MolPort-035-801-460 |
0.79 |
CC(=C)C1CC(CO)C2CCC3C(CCC4C3CCC3C4CCC(O)C3(C)C)C12
|
|
| MolPort-002-528-437 |
0.79 |
CC(=C)[C@@H]1CC[C@]2(CO)CC[C@]3(C)[C@H](CC[C@@H]4[C@@]5(C)CC[C@H](O)C(C)(C)C5CC[C@@]34C)C12
|
|
| MolPort-003-715-331 |
0.79 |
C[C@@](O)(CC[C@H]1[C@](C)(O)CCC2C(C)(C)CCC[C@]12C)C=C
|
|
| MolPort-000-846-064 |
0.79 |
CC(O)(CCC1C(C)(O)CCC2C(C)(C)CCCC12C)C=C
|
|
| MolPort-001-741-746 |
0.79 |
C[C@@]1(CO)CCC[C@@]2(C)[C@@H]3CC[C@@H]4C[C@]3(CC4=C)CC[C@H]12
|
|
| MolPort-005-909-866 |
0.79 |
CC(O)(CC[C@H]1[C@@](C)(O)CC[C@H]2C(C)(C)CCC[C@]12C)C=C
|
|
| MolPort-033-355-978 |
0.79 |
CC1(C)[C@@H]2C[C@H]1C(=C)[C@@H](O)C2
|
|
| MolPort-029-939-358 |
0.79 |
OC(CC1CC2CCC1C2)C=C
|
|
| MolPort-029-938-328 |
0.79 |
CC(O)(CC1CC2CCC1C2)C=C
|
|
| MolPort-029-887-077 |
0.79 |
C[C@@]1(O)CCC[C@]2(C)CC[C@H](C[C@@H]12)C(=C)CO
|
|
| MolPort-001-742-486 |
0.79 |
CC(=C)[C@@H]1CC[C@]2(CO)CC[C@]3(C)[C@H](CC[C@@H]4[C@@]5(C)CC[C@H](O)C(C)(C)[C@@H]5CC[C@@]34C)[C@@H]12
|
|
| MolPort-007-980-812 |
0.79 |
CC(=C)C1CCC2(CO)CC[C@]3(C)C(CCC4[C@@]5(C)CCC(O)C(C)(C)C5CC[C@@]34C)C12
|
|
| MolPort-009-765-555 |
0.79 |
C[C@@](O)(CC[C@H]1[C@](C)(O)CC[C@H]2C(C)(C)CCC[C@]12C)C=C
|
|
| MolPort-001-742-392 |
0.79 |
CC(O)(CO)C1CC[C@@]2(C)CCCC(=C)[C@@H]2C1
|
|
| MolPort-002-506-886 |
0.79 |
CC(O)(CC[C@H]1[C@](C)(O)CCC2C(C)(C)CCC[C@]12C)C=C
|
|
| MolPort-000-124-379 |
0.79 |
CC(O)(CCC1C(=C)CCC2C(C)(CO)CCCC12C)C=C
|
|
| MolPort-046-153-756 |
0.79 |
CC(C)CCC[C@@H](C)CCC[C@@H](C)CCCC(=C)C(O)CO
|
|
| MolPort-044-723-381 |
0.79 |
CC(=C)[C@@H]1CC[C@]2(C)CC[C@]3(C)[C@H](CC[C@@H]4[C@@]5(C)CC[C@H](O)[C@@](C)(CO)[C@@H]5CC[C@@]34C)[C@@H]12
|
|
| MolPort-046-195-008 |
0.79 |
CC(=C)[C@@H]1CC[C@]2(CO)CC[C@]3(C)[C@@H](CC[C@@H]4[C@@]5(C)CC[C@H](O)C(C)(C)[C@@H]5CC[C@@]34C)[C@H]12
|
|
| MolPort-044-723-367 |
0.79 |
CC(C)(O)[C@@H]1CC[C@@]2(C)CC[C@@H](O)C(=C)[C@@H]2C1
|
|
| MCULE-2789395858 |
0.79 |
C1C[C@]2(C)CC[C@@H](C(=C)CO)C[C@@]2([H])[C@@](O)(C)C1
|
|
| MCULE-8661901899 |
0.79 |
[C@H]12C[C@H](C1(C)C)C[C@@H](O)C2=C
|
|
| MCULE-5403675724 |
0.79 |
[H]C12CC(O)CCC1(C)C1CCC3(C)C(C(C)CCCC(C)C)CCC3C1C(=C)C2
|
|
| MCULE-8301181052 |
0.79 |
CC(C1(CCC2(CC2)CC1)O)=C
|
|
| MCULE-4046890531 |
0.79 |
OC1(C2(CCCC2)CC1)CCC=C
|
|
| MCULE-1936843086 |
0.79 |
OC1(C=C)CCC2(CC2)CC1
|
|
| MCULE-1171485409 |
0.79 |
CC1([C@@H]2CC[C@]([C@H](CC[C@](C=C)(O)C)[C@@]2(C)CCC1)(O)C)C
|
|
| MCULE-9104151244 |
0.79 |
CC(C1(C2(CCCCC2)CC1)O)=C
|
|
| MCULE-3903764638 |
0.79 |
C(C(CCC(O)C(=C)C)O)(C)=C
|
|
| MCULE-1977304897 |
0.79 |
C12C(CCC3C4C(C5CCC(C(C)(C)C5CC4)O)CCC13)C(CC2C(C)=C)CO
|
|
| MCULE-4774982120 |
0.79 |
C12(C)CCCC(C)(C)C1CCC(C)(O)C2CCC(C)(O)C=C
|
|
| MCULE-8905536335 |
0.79 |
[C@]12([H])C(CCC[C@]1(C)CCC(C(C)(CO)O)C2)=C
|
|
| MCULE-9779509739 |
0.79 |
[H]C12CC(O)CCC1(C)C1CCC3(C)C(C=C)(O)CCC3C1CC2
|
|
| MCULE-9063642375 |
0.79 |
[C@]12(C)CCCC(C)(C)[C@]1([H])CC[C@@](C)(O)[C@@H]2CC[C@@](C)(O)C=C
|
|
| MCULE-2732428803 |
0.79 |
[C@@]12(C)CCC3(C(C(CC3)C(C)=C)C1CCC1[C@@]2(C)CCC2C1(C)CCC(O)C2(C)C)CO
|
|
| MCULE-8544282007 |
0.79 |
C1C[C@]2(C)[C@@]3([H])CC[C@]4([H])[C@@]5([H])[C@H](C(=C)C)CC[C@]5(C)CC[C@@]4(C)[C@]3(C)CC[C@@]2([H])[C@@](CO)(C)[C@@H]1O
|
|
| MCULE-1881115671 |
0.79 |
C(CC=C)CCCCCCCCCCCCC(CC(O)CO)O
|
|
| MCULE-7043672096 |
0.79 |
CCCCCC(O)CC1CC1=C
|
|
| MCULE-8631625295 |
0.79 |
OC(C1CCC2(CC2)CC1)C=C
|
|
| MCULE-5061929584 |
0.79 |
CC(C(C1CCC2(CC2)CC1)O)=C
|
|
| MCULE-2611554707 |
0.79 |
C12(C)CCCC(C)(CO)C1CCC(=C)C2CCC(C)(O)C=C
|
|
| MCULE-2479027298 |
0.79 |
C12(C)CCC3(C([H])(C(CC3)C(C)=C)C1([H])CCC1([H])C2(C)CCC2(C1(C)CCC(O)C2(C)C)[H])CO
|
|
| MCULE-3387090376 |
0.79 |
OC1(C=C)C2(CCCCC2)CC1
|
|
| MCULE-7805667631 |
0.79 |
C(C)(=C)C1CCC2(C)CCC3(C)C(C21)CCC1C3(C)CCC2CC(O)(C(O)(C)C)CCC21C
|
|
| MCULE-5204543094 |
0.79 |
C1C[C@]2(C)[C@@]3([H])CC[C@]4([H])[C@@]5([H])[C@H](C(C)=C)CC[C@]5(CO)CC[C@@]4(C)[C@]3(C)CC[C@@]2([H])C(C)(C)[C@H]1O
|
|
| MCULE-8708469018 |
0.79 |
[C@]12(C)CCCC(C)(C)C1CCC(C)(O)C2CCC(=C)C=C
|
|
| MCULE-1652497439 |
0.79 |
C1C[C@]2(C)CC[C@@H](C(O)(C)C)C[C@@]2([H])C(=C)[C@@H]1O
|
|
| MCULE-2040575765 |
0.79 |
CC1([C@@]2([H])[C@]([C@@]3([C@](CC2)(C)[C@]2([C@]([C@@]4([C@](CC2)(CO)CC[C@H]4C(=C)C)[H])([H])CC3)C)[H])(C)CC[C@@H]1O)C
|
|
| MCULE-3861755240 |
0.79 |
C(O)(CO)C(CCCC(C(C)C)CCCCC)=C
|
|
| MCULE-4495844697 |
0.79 |
CC(C1(C(C2CC2)CCCC1)O)=C
|
|
| MCULE-1430857505 |
0.79 |
C1C[C@]2(C)[C@@]3([H])CC[C@]4([H])[C@@]5([H])[C@H](C(=C)C)CC[C@]5(C)CC[C@@]4(C)[C@]3(C)CC[C@@]2([H])[C@@](CO)(C)[C@H]1O
|
|
| MCULE-3410638328 |
0.79 |
OC1(C=C)C(C2CC2)CCCC1
|
|
| MCULE-9473637510 |
0.79 |
CC(C)CCC[C@@H](C)CCC[C@@H](C)CCCC(=C)C(O)CO
|
|
| MCULE-1154416056 |
0.79 |
OC1(C2(CCCC2)CC1)CC=C
|
|
| MCULE-3321074503 |
0.79 |
[C@@]12([H])C[C@H](O)C(C)(C)[C@@]1(O)[C@H](O)C[C@]13C[C@@](C)(O)[C@H](CC[C@@]1([H])C2=C)C3
|
|
| MolPort-001-792-183 |
0.78 |
OCC(O)CCCCC=C
|
|
| MolPort-002-509-736 |
0.78 |
CC(C)CCCC(C)CCCC(C)(O)C=C
|
|
| MolPort-006-122-641 |
0.78 |
CC(C)CCCC(C)(O)C=C
|
|
| MolPort-001-782-881 |
0.78 |
CCCCCC(O)C=C
|
|
| MolPort-046-672-339 |
0.78 |
OC1CCCCC1=C
|
|
| MolPort-046-014-136 |
0.78 |
O[C@@H]1CCC[C@H]1C=C
|
|
| MolPort-000-740-930 |
0.78 |
CC(C)CCCC(C)CCCC(C)CCCC(C)(O)C=C
|
|
| MCULE-4108462587 |
0.78 |
C(=C)C(C)(CCCC(C)CCCC(C)C)O
|
|
| MCULE-8561818472 |
0.78 |
C(=C)C(C)(CCCC(C)CCCC(C)CCCC(C)C)O
|
|
| MCULE-7332708916 |
0.78 |
C=C(CCCCCC(CO)=C)CO
|
|
| MCULE-5918819690 |
0.78 |
CC1CC(C(CC(C)=C)O)C1
|
|
| MCULE-6336857737 |
0.78 |
C(CO)(CCCCCCCCCC=C)CO
|
|
| MCULE-8025095993 |
0.78 |
C1CC(C=C)(O)CCCCC1
|
|
| MCULE-7479649773 |
0.78 |
C=C(CCCCCC(CO)=C)C
|
|
| MCULE-7830059101 |
0.78 |
C1CCC(O)C(=C)CCC1
|
|
| MCULE-5580405947 |
0.78 |
C1CCCCCC(C=C)(O)CCCCC1
|
|
| MolPort-006-132-534 |
0.77 |
CCCC(O)(CCC)CC=C
|
|
| MolPort-001-837-124 |
0.77 |
OCCCCCC=C
|
|
| MolPort-014-214-154 |
0.77 |
CCCC(O)CCC=C
|
|
| MCULE-3826405358 |
0.76 |
CC(C(C1C2C(C2)CCC1)O)=C
|
|
| MCULE-8837919765 |
0.76 |
OC(C1CC2C(C2)CC1)C=C
|
|
| MCULE-2211343054 |
0.76 |
CC(C(C1CC2C(C2)CC1)O)=C
|
|
| MCULE-2356143153 |
0.76 |
OC(C12CCCC1C2)C=C
|
|
| MCULE-9054991327 |
0.76 |
C1(=C)C2CCC1CC(CO)C2
|
|
| MCULE-9569994888 |
0.76 |
CC(C(C12CCCC1C2)O)=C
|
|
| MCULE-5895129214 |
0.76 |
CC(C(C12CCCCC1C2)O)=C
|
|
| MCULE-9230442087 |
0.76 |
OC(C12CCCCC1C2)C=C
|
|
| MCULE-8814843421 |
0.76 |
OC1(C=C)CC2CC(CC2)C1
|
|
| MCULE-1841707227 |
0.76 |
CC(C1(CC2CC(CC2)C1)O)=C
|
|
| MCULE-2616770713 |
0.76 |
C1C[C@]23C[C@@]42CC[C@]2(C)[C@@]([H])([C@@H](CCC(=C)C(C)C)C)CC[C@@]2(C)[C@]4([H])CC[C@@]3([H])[C@H](C)[C@H]1O
|
|
| MolPort-039-338-183 |
0.76 |
CC(=C)[C@@H]1CC[C@]2(C)CC[C@]3(C)[C@H](CC[C@@H]4[C@@]5(C)[C@H](O)C[C@H](O)C(C)(C)[C@@H]5CC[C@@]34C)[C@@H]12
|
|
| MolPort-028-599-902 |
0.76 |
CC(C)C(=C)CC[C@@H](C)[C@H]1CC[C@@]2(C)[C@@H]3CC[C@H]4[C@H](C)[C@@H](O)CC[C@@]44C[C@@]34CC[C@]12C
|
|
| MolPort-028-599-901 |
0.76 |
CC(C)C(=C)CC[C@@H](C)[C@H]1CC[C@@]2(C)[C@@H]3CC[C@@H]4[C@]5(C[C@@]35CC[C@]12C)CC[C@H](O)C4(C)C
|
|
| MolPort-035-706-374 |
0.76 |
CC(=C)[C@@H]1CC[C@]2(C)CC[C@]3(C)[C@H](CC[C@@H]4[C@@]5(C)[C@H](O)C[C@@H](O)C(C)(C)[C@@H]5CC[C@@]34C)[C@@H]12
|
|
| MolPort-046-158-389 |
0.76 |
CC(=C)[C@@H]1CC[C@]2(CO)CC[C@]3(C)[C@H](CC[C@@H]4[C@@]5(C)CC[C@H](O)[C@@](C)(CO)[C@@H]5CC[C@@]34C)[C@@H]12
|
|
| MolPort-046-693-376 |
0.75 |
CC(C)=CCCC(C)(O)[C@H]1CC[C@]2(C)[C@@H]1[C@H](O)C[C@@H]1[C@@]3(C)CC[C@H](O)C(C)(C)[C@@H]3CC[C@@]21C
|
|
| MolPort-020-005-760 |
0.75 |
CC(C)=CCC[C@](C)(O)[C@H]1CC[C@]2(C)[C@@H]1[C@H](O)C[C@@H]1[C@@]3(C)CC[C@H](O)C(C)(C)[C@@H]3[C@@H](O)C[C@@]21C
|
|
| MolPort-020-005-763 |
0.75 |
CC(C)=CCC[C@@](C)(O)[C@H]1CC[C@]2(C)[C@@H]1[C@H](O)C[C@@H]1[C@@]3(C)CC[C@H](O)C(C)(C)[C@@H]3CC[C@@]21C
|
|
| MolPort-002-510-446 |
0.75 |
CC(C)=CCC[C@](C)(O)[C@H]1CC[C@]2(C)[C@@H]1[C@H](O)CC1[C@@]3(C)CC[C@H](O)C(C)(C)[C@@H]3CC[C@@]21C
|
|
| MolPort-046-423-229 |
0.75 |
CC(C)=CCCC(C)(O)[C@H]1CC[C@@]2(C)[C@@H]1[C@H](O)C[C@@H]1[C@@]3(C)CC[C@H](O)C(C)(C)C3[C@@H](O)C[C@@]21C
|
|
| MolPort-027-835-420 |
0.75 |
CC(C)=CCC[C@@](C)(O)[C@H]1CC[C@@]2(C)[C@@H]1[C@H](O)C[C@@H]1[C@@]3(C)CC[C@H](O)C(C)(C)[C@@H]3CC[C@@]21C
|
|
| MolPort-002-512-911 |
0.75 |
CC(CCC(O)C(C)(C)O)C=C
|
|
| MolPort-023-220-754 |
0.75 |
CC(C)=CCC[C@@](C)(O)[C@H]1CC[C@]2(C)[C@@H]1[C@H](O)C[C@@H]1[C@@]3(C)CC[C@H](O)C(C)(C)[C@@H]3[C@@H](O)C[C@@]21C
|
|
| MolPort-029-945-682 |
0.75 |
CC(C)=CCC[C@](C)(O)[C@H]1CC[C@]2(C)[C@@H]1[C@H](O)C[C@@H]1[C@@]3(C)CC[C@H](O)C(C)(C)[C@@H]3CC[C@@]21C
|
|
| MolPort-046-761-778 |
0.75 |
CC(C)=CCCC(C)(O)[C@H]1CC[C@]2(C)C1[C@H](O)C[C@@H]1[C@@]3(C)CC[C@H](O)C(C)(C)[C@@H]3CC[C@@]21C
|
|
| MCULE-1361042454 |
0.75 |
C[C@@]12C[C@H](O)[C@@]3([H])C([C@@H](O)CC[C@]3(C)[C@@]1([H])C[C@@H](O)[C@]1([H])[C@@]([H])([C@@](O)(C)CC/C=C(\C)/C)CC[C@@]21C)(C)C
|
|
| MCULE-6770484471 |
0.75 |
CC(C(CC1CCCC1)(O)C)=C
|
|
| MCULE-8806913722 |
0.75 |
CCC1C(C=C)(O)CCCCC1
|
|
| MCULE-1364206981 |
0.75 |
CC(C=C)(CC1CCCC1)O
|
|
| MCULE-4124749273 |
0.75 |
CC(C(C1C2(CC2)C1)O)=C
|
|
| MCULE-6612769472 |
0.75 |
CC(C(C1CC2(CCC2)C1)O)=C
|
|
| MCULE-6373444184 |
0.75 |
CC(C1C(C=C)(O)CCCCC1)C
|
|
| MCULE-1163586740 |
0.75 |
CC1C(C=C)(O)CCCCC1
|
|
| MCULE-2871959103 |
0.75 |
C[C@@]12CC[C@@]3([H])C([C@@H](O)CC[C@]3(C)[C@@]1([H])C[C@@H](O)[C@]1([H])[C@@]([H])([C@](O)(C)CC/C=C(\C)/C)CC[C@@]21C)(C)C
|
|
| MCULE-2742387399 |
0.75 |
CC1C(C)(C)C(C(C(C)=C)O)(C)CC1
|
|
| MCULE-4866846067 |
0.75 |
CC(C1C(C(C)=C)(O)CCCCC1)C
|
|
| MCULE-2585598299 |
0.75 |
C/C(=C/CCC(C1C2C(CC3C(C)(C2(C)CC1)CCC1C3(CCC(C1(C)C)O)C)O)(O)C)/C
|
|
| MCULE-6356568434 |
0.75 |
OC(C1CC2(CCC2)C1)C=C
|
|
| MCULE-8115884500 |
0.75 |
OC(C1C(C2CC2)C1)C=C
|
|
| MCULE-7463891162 |
0.75 |
CC(C(C1C(C2CC2)C1)O)=C
|
|
| MCULE-6910147399 |
0.75 |
CC1C(C(C)=C)(O)CCCCC1
|
|
| MCULE-1572938680 |
0.75 |
C1C[C@]2(C)[C@@]3([H])C[C@@H](O)[C@]4([H])[C@@]([H])([C@](C)(CC/C=C(\C)/C)O)CC[C@@]4(C)[C@]3(C)C[C@H](O)[C@@]2([H])C(C)(C)[C@H]1O
|
|
| MCULE-2620336582 |
0.75 |
CCC1C(C(C)=C)(O)CCCCC1
|
|
| MCULE-9020191331 |
0.75 |
C1C[C@]2(C)[C@@]3([H])C[C@@H](O)[C@]4([H])[C@@]([H])([C@](C)(CC/C=C(/C)\C)O)CC[C@@]4(C)[C@]3(C)CC[C@@]2([H])C(C)(C)[C@H]1O
|
|
| MCULE-4732733810 |
0.75 |
C1[C@@]2(C)[C@@]([H])([C@@H](O)C[C@]3(C)[C@]2([H])C[C@@H](O)[C@@]2([H])[C@@]3(C)CC[C@@H]2[C@](O)(CC/C=C(\C)/C)C)C(C)(C)[C@@H](O)C1
|
|
| MCULE-6646668513 |
0.75 |
C[C@@]12C[C@H](O)[C@@]3([H])C([C@@H](O)CC[C@]3(C)[C@@]1([H])C[C@@H](O)[C@]1([H])[C@@]([H])([C@](O)(C)CC/C=C(\C)/C)CC[C@@]21C)(C)C
|
|
| MCULE-8244497957 |
0.75 |
CC(C1CCC1)C(C=C)O
|
|
| MCULE-3450777603 |
0.75 |
O[C@@H]1C(C)(C)[C@@]2([H])[C@@](C)([C@]3([H])[C@@](C)(CC2)[C@]2(C)[C@@]([H])([C@@H]([C@](CC/C=C(/C)\C)(C)O)CC2)[C@H](O)C3)CC1
|
|
| MCULE-6548923859 |
0.75 |
[C@@]12(C)CC[C@@]3([H])C(C)(C)[C@H](CC[C@]3(C)[C@@]1([H])C[C@@H](O)[C@]1([C@@]2(C)CC[C@]1([H])[C@](C)(O)CC/C=C(/C)\C)[H])O
|
|
| MCULE-3139667111 |
0.75 |
C12C3C4C5C1C(C1C5C(C4CC3(C=C)O)CC1(C=C)O)CC2
|
|
| MCULE-1672318153 |
0.75 |
C(C)(C)(O)C(O)CCC(C)C=C
|
|
| MolPort-006-111-949 |
0.74 |
CC(C)=C1CCC(C)(O)CC1
|
|
| MolPort-039-338-153 |
0.74 |
CC1(C)C[C@@H](O)C[C@@]2(C)[C@@H]3CC[C@H]4C[C@@]3(C[C@@H](O)[C@H]12)[C@@H](O)C4=C
|
|
| MolPort-035-706-223 |
0.74 |
CC(C)=C1CC[C@]2(C)CCC[C@](C)(O)[C@H]2C1
|
|
| MCULE-9677910881 |
0.74 |
CC1CC(CC/C=C(\C)/C)(O)CCC1
|
|
| MCULE-2532107825 |
0.74 |
C/C(/C)=C/CCC1(CCCCC1)O
|
|
| MCULE-6288478354 |
0.74 |
C1C[C@@]2(C)CC/C(=C(\C)/C)/C[C@]2([H])[C@@](C)(O)C1
|
|
| MCULE-8065006413 |
0.74 |
CC1C(CC/C=C(\C)/C)(O)CCCC1
|
|
| MCULE-3304428106 |
0.74 |
CC1CCC(CC/C=C(\C)/C)(O)CC1
|
|
| MCULE-6376135384 |
0.74 |
C1(/CCC(CC/1)(C)O)=C(\C)/C
|
|
| MCULE-5222419035 |
0.74 |
C(CCCC(CCCC=C)O)=C
|
|
| MCULE-6143890058 |
0.74 |
CCCCC(O)C(=C)C
|
|
| MCULE-7733391384 |
0.74 |
OC(C1CC1)CCC=C
|
|
| MCULE-2480188021 |
0.74 |
C=C(C)CC(O)CC(=C)C
|
|
| MCULE-8099792256 |
0.74 |
C(C)(O)(CC(C)=C)CC(C)=C
|
|
| MolPort-011-137-006 |
0.74 |
OC(CCC=C)C1CC1
|
|
| MolPort-044-729-184 |
0.74 |
OCC1(CC=C)CCC1
|
|
| MolPort-042-623-499 |
0.74 |
OC(CC=C)(C1CC1)C1CC1
|
|
| MolPort-035-943-082 |
0.74 |
OC(CCCC=C)CCCC=C
|
|
| MolPort-039-338-372 |
0.73 |
CC1(C)[C@@H]2CCC(=C)[C@@H]3CC[C@](C)(O)[C@H]3[C@H]12
|
|
| MolPort-023-298-938 |
0.73 |
CC(C)(O)C(O)CCC(C)(O)C=C
|
|
| MolPort-027-853-716 |
0.73 |
CC(CCC(O)C(C)=C)C1CCC2(C)C3CCC4C5(CC35CCC12C)CCC(O)C4(C)C
|
|
| MolPort-028-599-900 |
0.73 |
C[C@H](CCC(O)C(C)=C)[C@H]1CC[C@@]2(C)[C@@H]3CC[C@@H]4[C@]5(C[C@@]35CC[C@]12C)CC[C@H](O)C4(C)C
|
|
| MolPort-019-937-135 |
0.73 |
CC(C)(O)C1CCC2(C)CC(O)C(=C)CCC(O)C(=C)CCC12
|
|
| MolPort-029-942-916 |
0.73 |
CC(=C)[C@H]1C[C@@H](O)C(=C)CC[C@@H](O)C(=C)[C@@H](O)C1
|
|
| MCULE-8949375623 |
0.73 |
C/C(/C)=C/CCC1CC(O)CCC1
|
|
| MCULE-5186230452 |
0.73 |
C1[C@@H](O)C([C@@H](O)C[C@@H](C(=C)C)C[C@@H](O)C(C1)=C)=C
|
|
| MCULE-6884668769 |
0.73 |
CC(O)(C)C(O)CCC(O)(C)C=C
|
|
| MCULE-9401006600 |
0.73 |
C1CC23CC42CCC2(C)C(C(CCC(O)C(=C)C)C)CCC2(C)C4CCC3C(C)(C)C1O
|
|
| MCULE-5247658406 |
0.73 |
C1(O)C(=C)CCC2C(C(O)(C)C)CCC2(C)CC(O)C(=C)CC1
|
|
| MCULE-9389315586 |
0.73 |
CCC(C)C(O)CC=C
|
|
| MolPort-001-793-916 |
0.73 |
CCCC(O)CC=C
|
|
| MolPort-014-214-016 |
0.73 |
CC(O)CCC(C)=C
|
|
| MolPort-011-284-754 |
0.73 |
CCC(O)CCC=C
|
|
| MolPort-035-706-273 |
0.72 |
CC(C)=C[C@H]1CC[C@]2(C)[C@@H]1[C@@](C)(O)CC[C@H]2O
|
|
| MCULE-1585616264 |
0.72 |
C1[C@@H](O)[C@]2(C)CC[C@]([H])(/C=C(/C)\C)[C@@]2([H])[C@](O)(C)C1
|
|
| MCULE-1464171624 |
0.72 |
OC1(C=C)C2(CCCC2)CC1
|
|
| MCULE-7116988819 |
0.72 |
CC(C1(C2(CCCC2)CC1)O)=C
|
|
| MolPort-035-706-357 |
0.71 |
CC(C)=CCC[C@](C)(O)[C@H]1CC[C@]2(C)[C@@H]1CC[C@@H]1[C@@]3(C)CC[C@H](O)C(C)(C)[C@@H]3CC[C@@]21C
|
|
| MCULE-7060414091 |
0.71 |
OCC1(CC=CC1)CC1CCCCC1
|
|
| MCULE-5351377157 |
0.71 |
C/C(/C)=C/CCC1(C2CC(CC2)C1)O
|
|
| MCULE-8634856533 |
0.71 |
C1CC2(OC)CCC1CC2CC=C
|
|
| MCULE-4532771641 |
0.71 |
CC(O)CC(O)CC=C
|
|
| MCULE-3299865248 |
0.71 |
CC1CC(C(C(C)=C)O)C1
|
|
| MolPort-046-761-951 |
0.70 |
C\C=C1/CC[C@H]2[C@@H]3CC[C@H]4C[C@H](O)CC[C@]4(C)[C@H]3CC[C@]12C
|
|
| MCULE-3492445798 |
0.70 |
C/C(/C)=C/CCC1C(O)CCCC1
|
|
| MCULE-3634019791 |
0.70 |
CC1CC(CC/C=C(\C)/C)C(O)CC1
|
|
| MCULE-5812699460 |
0.70 |
OCC1(CCCCC1)CC1CC=CC1
|
|
| MCULE-6675572295 |
0.70 |
C/C(/C)=C/CC[C@H]1[C@@](O)(C)CCCC1
|
|
| MCULE-1988512755 |
0.70 |
C/C(/C)=C/CCC1C(O)(C)CCCC1
|
|
| MolPort-025-798-651 |
0.70 |
OC1(CC=C)CCC1
|
|
| MolPort-020-915-860 |
0.70 |
CC(O)CCCC=C
|
|
| MCULE-5887388555 |
0.69 |
C(=C/CCC(C)CC(O)C)(/C)\C
|
|
| MCULE-7835659960 |
0.69 |
C/C(/C)=C/CCC1(C2C(C2)CC1)O
|
|
| MCULE-2124537298 |
0.69 |
C/C(/C)=C/CCC1(C2C(C2)CCC1)O
|
|
| MCULE-8049369443 |
0.69 |
NC1CCC(C(CC=C)O)CC1
|
|
| MCULE-9929984425 |
0.69 |
OCC1(C2C3CC(CC3)C2)CC=CC1
|
|
| MCULE-9021614797 |
0.69 |
NC1CC(C(CC=C)O)CCC1
|
|
| MCULE-4181084310 |
0.69 |
NC12CCC(C(CC=C)O)(CC1)CC2
|
|
| MCULE-6626480267 |
0.68 |
C1CC2C(O)C3CC=CCC3C(O)C2CC=1
|
|
| MCULE-7446284675 |
0.68 |
C1=CC2CCC1C(CO)C2CO
|
|
| MCULE-7760721294 |
0.68 |
C1CC2(CCCCC2(CO)C(C)C=1)CO
|
|
| MCULE-7680986050 |
0.68 |
CCC(C)(O)CC(=C)C
|
|
| MCULE-6005158959 |
0.68 |
CC1CC(CC2CC=CC2)(O)CCC1
|
|
| MCULE-3959532000 |
0.68 |
C/C(/C)=C/CCC1(CCCCCC1)O
|
|
| MCULE-1889985819 |
0.68 |
C/C(/C)=C/C(CC1CCCCC1)(O)C
|
|
| MCULE-3287434696 |
0.68 |
C/C(/C)=C/CCC1(C(C)(C)CCC1)O
|
|
| MCULE-7590026618 |
0.68 |
CC1C(CC2CC=CC2)(O)CCCC1
|
|
| MCULE-7634836202 |
0.68 |
CC1C(CC/C=C(\C)/C)(O)CCC1
|
|
| MCULE-7502094563 |
0.68 |
OC1(CCCCC1)CC1CC=CC1
|
|
| MCULE-7364976100 |
0.68 |
C1[C@@H](O)[C@]2(C)CC=C(C(C)C)C[C@@]2([H])[C@@](C)(O)C1
|
|
| MCULE-4154375600 |
0.68 |
C12(C(CC=CC1)(CO)CCCC2)CO
|
|
| MolPort-039-337-367 |
0.68 |
C\C=C\C(O)C1CCCCC1
|
|
| MolPort-035-706-318 |
0.68 |
CC1(C)[C@@H](O)CC[C@]2(C)[C@@H](CC[C@H]3C(=O)CC[C@H]4C(C)(C)[C@@H](O)CC[C@]34C)C(=C)CC[C@@H]12
|
|
| MolPort-039-052-525 |
0.68 |
CC(C)C1=CC[C@@]2(C)[C@H](O)CC[C@](C)(O)[C@@H]2C1
|
|
| MCULE-7682763192 |
0.67 |
[C@@]12(C)CC[C@@]3(CO)CC[C@@H](C)[C@H](C)[C@@]3([H])C1=CC[C@]1([H])[C@@]3(C)CC[C@H](O)C(C)(C)[C@]3([H])CC[C@]12C
|
|
| MCULE-1155196972 |
0.67 |
NC1C(C(CC=C)O)CCCC1
|
|
| MCULE-9083020972 |
0.67 |
C1C[C@@]2(C)CC[C@@H](C(O)(C)C)CC2=C(C)C1
|
|
| MCULE-6216454596 |
0.67 |
CC(CC(C1C(N)CCCC1)O)=C
|
|
| MCULE-3947475166 |
0.67 |
C[C@@]1(CC[C@H](O)C[C@@H]1CO)[C@@]1([H])CC[C@@]2(C(=C)CC[C@@]2([H])[C@@H]1CN)C
|
|
| MCULE-6558902337 |
0.67 |
NC1(C(CC=C)O)CCCCC1
|
|
| MCULE-3918504016 |
0.67 |
[C@@]12([H])CC[C@@](O)(CC=C)[C@@]1(C)CC[C@]1([H])[C@@]3([H])CCCC=C3CC[C@@]21[H]
|
|
| MCULE-6340408888 |
0.67 |
C1CC2(C)C3CCC(=C)C(CC(=O)O)C3(C)CCC2C(C)(C)C1
|
|
| MCULE-2166901683 |
0.67 |
C(O)(CCC=C)C(=C)C
|
|
| MCULE-3507145969 |
0.67 |
CC1CC(C(CC(C)=C)O)(N)CCC1
|
|
| MCULE-4729152230 |
0.67 |
C12CCC(C(C)CCCC(C)C)C1(C)CCC1=C3CCC(O)CC3(C(O)CC21)C
|
|
| MCULE-9666470335 |
0.67 |
O[C@@]1(CC=C)CC[C@]2([H])[C@]1(C)CC[C@]1([H])[C@@]3([H])CCCC=C3CC[C@@]21[H]
|
|
| MCULE-9669832293 |
0.67 |
[C@@]1(C)([C@H](O)C/C=C(\C)/C)C2CCC(C2)[C@@]1(C)O
|
|
| MCULE-4070893267 |
0.67 |
C1(O)CC(CCC1N)C=C
|
|
| MCULE-3732793313 |
0.67 |
C/C(/C)=C/CCC1CC(O)CC1
|
|
| MCULE-7790352459 |
0.67 |
C[C@@]1([C@H](CC2CCCC=2)CCCC1)O
|
|
| MCULE-9127936983 |
0.67 |
C1C(O)C2(C)CCC(C(C(O)=O)=C)C(O)C2C(=C)C1
|
|
| MCULE-5010058438 |
0.67 |
[H]C12CCCC=C1CCC1C3CCC(CC=C)(O)C3(C)CCC21
|
|
| MCULE-1536375497 |
0.67 |
CC1(C(CC2CCCC=2)CCCC1)O
|
|
| MCULE-1607606730 |
0.67 |
CC1C(CC/C=C(\C)/C)CCC1O
|
|
| MCULE-3444922346 |
0.67 |
C/C(/C)=C/CCC1(CC(O)CC1)C
|
|
| MCULE-2246342919 |
0.67 |
C/C(/C)=C/CCC1CC(O)CCCC1
|
|
| MCULE-1620592725 |
0.67 |
C12=CCC3(C(C)(CCC4([H])C(C(O)CCC34C)(C)C)C1(C)CCC1(CO)CCC(C)C(C)C21[H])[H]
|
|
| MCULE-7205970629 |
0.67 |
C(C(C)CCCC(C)(C)OC)=C
|
|
| MCULE-2024084823 |
0.67 |
C1(CCC(CC1)(CC=C)O)(F)F
|
|
| MolPort-046-147-781 |
0.67 |
CC1C(O)C[C@@H](CC1C#N)C(C)=C
|
|
| MolPort-019-937-479 |
0.67 |
CC1(C)C[C@@H](O)[C@]2(C)CC[C@]3(C)C(=CCC4[C@@]5(C)CC[C@H](O)C(C)(C)C5CC[C@@]34C)[C@@H]2C1
|
|
| MolPort-003-959-866 |
0.67 |
C[C@@H]1CC[C@]2(CO)CC[C@]3(C)C(=CC[C@@H]4[C@@]5(C)CC[C@H](O)C(C)(C)[C@@H]5CC[C@@]34C)[C@@H]2[C@H]1C
|
|
| MolPort-003-986-853 |
0.67 |
C[C@]12CC[C@H]3[C@@H](CCC4=CCCC[C@H]34)[C@@H]1CC[C@@]2(O)CC=C
|
|
| MolPort-046-702-738 |
0.67 |
C\C=C(/C)CCCC(C)(C)O
|
|
| MolPort-002-911-117 |
0.67 |
CC(C)CCCC(C)C1CCC2C3CC(O)C4(C)CC(O)CCC4=C3CCC12C
|
|
| MolPort-046-417-914 |
0.67 |
C[C@]12CC[C@@H]([C@@H](CN)[C@@H]1CCC2=C)[C@@]1(C)CC[C@H](O)C[C@@H]1CO
|
|
| MolPort-004-802-491 |
0.67 |
NC1CCC(CC1O)C=C
|
|
| MolPort-003-925-627 |
0.67 |
CC1(C)CC[C@]2(CO)CC[C@]3(C)C(=CC[C@@H]4[C@@]5(C)CC[C@H](O)C(C)(C)[C@@H]5CC[C@@]34C)[C@@H]2C1
|
|
| MolPort-046-148-705 |
0.67 |
OCCC1CC(=C)C1
|
|
| MolPort-026-962-345 |
0.67 |
OC1(CCCC1)C=C
|
|
| MolPort-027-637-273 |
0.67 |
CC1=C2C[C@@H](CC[C@]2(C)CCC1)C(C)(C)O
|
|
| MolPort-022-371-002 |
0.67 |
OC(=O)C1(CC=C)CCCCC1
|
|
| MolPort-044-657-110 |
0.67 |
OC(=O)CC1(CCCCC1)C=C
|
|
| MolPort-046-764-482 |
0.67 |
C[C@]12CC[C@H]3[C@@H](CC[C@H]4C[C@H](O)CC(=C)[C@]34C)[C@@H]1CCC2=O
|
|
| MolPort-046-774-180 |
0.67 |
OC(=O)C1(CCCCC1)C=C
|
|
| MolPort-001-762-271 |
0.67 |
COC(C)(C)CCCC(C)C=C
|
|
| MolPort-038-386-720 |
0.67 |
CC1(C)CCCC2(C)C1CCC1(C)C(CC(O)=O)C(=C)CCC21
|
|
| MolPort-039-338-446 |
0.67 |
CC1(C)CC[C@]2(C)CC[C@]3(C)C(=CC[C@@H]4[C@@]5(C)CC[C@H](O)C(C)(C)[C@@H]5[C@H](O)C[C@@]34C)[C@@H]2C1
|
|
| MCULE-4829210533 |
0.66 |
C/C(/C)=C/C1(CCC2(CC2)CC1)O
|
|
| MCULE-8330160340 |
0.66 |
[C@@]12(C)CCC[C@@](C)(C(O)=O)[C@@]1([H])CCC(=C)[C@H]2CCC(C)CCO
|
|
| MCULE-6673315997 |
0.66 |
C/C(/C)=C/C1(C2(CCCCC2)CC1)O
|
|
| MCULE-1610753841 |
0.66 |
CC(C(C1CCC(CN)CC1)O)=C
|
|
| MCULE-4713145304 |
0.66 |
C1C[C@]2(C)[C@@]([H])(CC[C@@H](C)CCO)C(=C)CC[C@@]2([H])[C@@](C)(C(O)=O)C1
|
|
| MCULE-5419694681 |
0.66 |
OCC1(C2CCCCCC2)CC=CC1
|
|
| MCULE-2278855920 |
0.66 |
CC1(CCCC1)CC1(CC=CC1)CO
|
|
| MCULE-4398307489 |
0.66 |
C/C(/C)=C/C1(C(C2CC2)CCCC1)O
|
|
| MCULE-6794880716 |
0.66 |
C/C(/C)=C/C(C1CCC2(CC2)CC1)O
|
|
| MCULE-2184969189 |
0.66 |
OCC1(CC2C(C2)C1)CC1CC=CC1
|
|
| MCULE-7089035597 |
0.66 |
C12=CCC3(C(C)(CCC4([H])C(C(O)CCC34C)(C)C)C1(C)CCC1(C)CCC(C)C(C)C21[H])[H]
|
|
| MCULE-3247130765 |
0.66 |
OC1CC(CC2CC=CCC2)CCC1
|
|
| MCULE-1097149426 |
0.66 |
OC1C(CC2CC=CCC2)CCCC1
|
|
| MCULE-2960240255 |
0.66 |
O[C@H]1CC[C@@]2(C)[C@@H](CC[C@@]3(C)C4=CC[C@@]5(C)CCC(C)(C)C[C@H]5[C@]4(C)CC[C@H]23)C1(C)C
|
|
| MCULE-4393909687 |
0.66 |
C1CC2(C)C(CCC(C)CC(=O)O)C(=C)CCC2C(C)(C(=O)O)C1
|
|
| MCULE-6689462252 |
0.66 |
OCCCC1C2C=CC(CC2)C1
|
|
| MCULE-4888197133 |
0.66 |
C1(=O)CC2(C)C(CCC(C)CCO)C(=C)CCC2C(C)(C)C1
|
|
| MolPort-046-509-053 |
0.66 |
CC1(C)C[C@H]2C3=CC[C@@H]4[C@@]5(C)CC[C@H](O)[C@@](C)(CO)[C@@H]5CC[C@@]4(C)[C@]3(C)C[C@H](O)[C@@]2(CO)C[C@@H]1O
|
|
| MolPort-046-067-628 |
0.66 |
O[C@H]1C2CCC[C@H]1C1=C(CCCC1)C2
|
|
| MolPort-035-706-315 |
0.66 |
C[C@H]1[C@@H]2[C@H]3CC[C@@H]4[C@@]5(C)CC[C@H](O)C(C)(C)[C@@H]5CC[C@@]4(C)[C@]3(C)CC[C@@]2(C)CC=C1C
|
|
| MolPort-029-943-094 |
0.66 |
CC(CCC1C(=C)CCC2C1(C)CCCC2(C)C(O)=O)CC(O)=O
|
|
| MolPort-028-754-127 |
0.66 |
CC1(C)CC[C@]2(C)CC=C3[C@]4(C)CC[C@H]5C(C)(C)[C@@H](O)CC[C@]5(C)[C@H]4CC[C@@]3(C)[C@@H]2C1
|
|
| MolPort-046-764-556 |
0.66 |
C[C@]12CC[C@@H]3[C@@H](CC[C@@H]4C[C@@H](O)CC[C@]34C)[C@H]1CC=C2
|
|
| MolPort-001-742-582 |
0.66 |
CC(CCO)CC[C@@H]1C(=C)CC[C@H]2[C@@]1(C)CCC[C@@]2(C)C(O)=O
|
|
| MolPort-039-338-300 |
0.66 |
CC1(C)CC[C@]2(C)CC=C3[C@]4(C)CC[C@H]5C(C)(C)[C@H](O)CC[C@]5(C)[C@H]4CC[C@@]3(C)[C@@H]2C1
|
|
| MolPort-039-338-134 |
0.66 |
CC1(C)CC[C@]2(C)CC[C@]3(C)C(CC[C@@H]4[C@@]5(C)CC[C@H](O)C(C)(C)[C@@H]5CC[C@@]34C)=C2C1
|
|
| MolPort-001-782-919 |
0.66 |
OCCC1CCCC=C1
|
|
| MolPort-035-705-910 |
0.66 |
C[C@@H](CCO)CC[C@H]1C(=C)CC[C@@H]2[C@]1(C)CCC[C@]2(C)C(O)=O
|
|
| MolPort-003-892-645 |
0.66 |
C[C@@H]1CC[C@]2(C)CC[C@]3(C)C(=CC[C@@H]4[C@@]5(C)CC[C@H](O)C(C)(C)[C@@H]5CC[C@@]34C)[C@@H]2[C@H]1C
|
|
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0.66 |
CC(C)C1=C2CC[C@]3(C)[C@H](CC[C@@H]4[C@@]5(C)CC[C@H](O)C(C)(C)[C@@H]5CC[C@@]34C)[C@@]2(C)CC1
|
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0.66 |
CC(CCO)CCC1C(=C)CCC2C(C)(C)CC(=O)CC12C
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0.66 |
C[C@]12CC[C@@H]3[C@@H](CC[C@@H]4CC(O)CC[C@]34C)[C@H]1CC=C2
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0.66 |
C[C@]12CC[C@H]3[C@@H](CC[C@H]4C[C@@H](O)CC[C@]34C)[C@@H]1CC=C2
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0.66 |
CC1(C)CC[C@]2(C)CC[C@]3(C)C(=CC[C@@H]4[C@@]5(C)CC[C@H](O)C(C)(C)[C@@H]5CC[C@@]34C)[C@@H]2C1
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0.65 |
C[C@H](CCO)CCC=C(C)C
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CC(CCO)CCC=C(C)C
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C[C@@H](CCO)CCC=C(C)C
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| MolPort-046-647-387 |
0.65 |
OCC1(CCC1)C=C
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|
| MCULE-3946157075 |
0.65 |
C(/C)(\C)=C/CC[C@@H](C)CCO
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|
| MCULE-2407386794 |
0.65 |
[C@@H](C)(CCO)CC/C=C(\C)/C
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0.65 |
C(/C)(\C)=C/CCC(C)CCO
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| MCULE-4399439382 |
0.65 |
C(/C)(\C)=C/CC[C@@H](C)CCO
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0.65 |
C(/C)(\C)=C/CC[C@H](C)CCO
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C12(C)CC(CC(C)(CO)C1([H])CCC1=CC(C)(C(O)CO)CCC21[H])O
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C1CC2(CO)C(CO)C(C)=CCC2C(CO)(C)C1
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[C@H]1(O)C[C@@]2(C)[C@]3([H])CC[C@@]([C@@H](O)CO)(C)C=C3CC[C@]2([H])[C@](C)(CO)C1
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0.65 |
OC[C@](O)([C@]1(CC[C@@]2(C(CC[C@]3([C@]2(C[C@@](C[C@]3(CO)C)(O)[H])C)[H])=C1)[H])C)[H]
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0.65 |
OC[C@H]1[C@H]2C=C[C@H](CC2)C1
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CC(CC(C1C2CC(CC2)C1N)O)=C
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[C@]1(C)(C(CC=C)O)CCC(=CC1C)C
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C123C=CC1(CCC(O)C2)CCCC3
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OC1C(C/C=C(\Cl)/Cl)CCCC1
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C12(CCC(C(C)(C)C1=C)C2)C(O)=O
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0.65 |
NC1C2CC(CC2)C1C(CC=C)O
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CCC1CC(C/C=C(\Cl)/Cl)C(O)CC1
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0.65 |
C1C[C@@]2([H])[C@H](C)CC[C@@](O)(C(C)C)[C@@]2([H])C=C1C
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|
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0.65 |
CC1CC(C/C=C(\Cl)/Cl)C(O)CC1
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|
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0.65 |
CC1(CO)CC(O)CC2(C)C3CCC(C)(C=C3CCC12)C(O)CO
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C[C@@]1(CO)C[C@@H](O)C[C@@]2(C)[C@@H]3CC[C@@](C)(C=C3CC[C@H]12)[C@@H](O)CO
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CC1=CCC2C(C)(CO)CCCC2(CO)C1CO
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OC[C@@H]1C[C@H]2CC[C@@H]1C=C2
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CC1C=C(C)CC[C@@]1(C)C(O)CC=C
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C[C@H]1[C@H]2[C@H]3CC[C@@H]4[C@@]5(C)CC[C@H](O)C(C)(C)[C@@H]5CC[C@@]4(C)[C@]3(C)C[C@H](O)[C@@]2(C)CC=C1C
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CC1(C)C2CCC(C2)(C([O-])=O)C1=C
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OCC1CC2CCC1C=C2
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CC1=CC[C@H]2C(C)(C)CCC[C@]2(C)[C@H]1CO
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C\C(C=C)=C\C[C@H]1[C@](C)(O)CC[C@H]2C(C)(C)CCC[C@]12C
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OC1CCCCC1C1=CCCCC1
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CC(C)(O)[C@H](O)CCC(=C)[C@H]1CC[C@]2(C)[C@@H]1CC[C@@H]1[C@@]3(C)CCC(=O)C(C)(C)[C@@H]3CC[C@@]21C
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CC(C)CCCC(C)CCCC(C)CCC\C(C)=C\CC(CO)C(=C)CCCC(C)CCCC(C)CCCC(C)C
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CC1(C)C2CCC(C2)(C(O)=O)C1=C
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CC(C)=C1CCC(C)(O)CC1.CC(=C)C1CCC(C)(O)CC1.CC1=CCC(CC1)C(C)(C)O
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CC1(C)CC[C@]2(CO)CC=C3[C@]4(C)CC[C@H]5C(C)(C)[C@@H](O)CC[C@]5(C)[C@H]4CC[C@@]3(C)[C@@H]2C1
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CC1(C)CC[C@]2(CO)[C@@H](O)C[C@]3(C)C(=CC[C@@H]4[C@@]5(C)CC[C@H](O)[C@@](C)(CO)[C@@H]5CC[C@@]34C)[C@@H]2C1
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CC(=C)[C@@H](O)CC[C@](C)(O)[C@H]1CC[C@]2(C)[C@@H]1CC[C@@H]1[C@@]3(C)CCC(=O)C(C)(C)[C@@H]3CC[C@@]21C
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C[C@@H]1C[C@H](O)[C@]2(C)[C@@H](O)C[C@]3(C)C(=CC[C@@H]4[C@@]5(C)CC[C@H](O)C(C)(C)[C@@H]5CC[C@@]34C)[C@@H]2[C@H]1C
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CC(C)[C@]1(O)CC[C@@H](C)[C@@H]2CCC(C)=C[C@H]12
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CC1(C)C[C@@H](O)[C@]2(C)CC[C@]3(C)C(=CC[C@@H]4[C@@]5(C)CC[C@H](O)[C@](C)(CO)[C@@H]5CC[C@@]34C)[C@@H]2C1
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CCCCCCCCCC\C=C/CCCCCCCCO
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CC=C[C@@H]1CCC[C@H]1O
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CCC\C=C/CCCCCCCO
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CCCC\C=C\CCCCCCO
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CCCCCC\C=C/CCCCCCCCO
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C=CCCCCCCC1CO1
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CCCC\C=C/CCCCCCCCCCO
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CCCCCCCC\C=C/CCCCCCCCO
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CC\C=C\CCCCCCCCCCO
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CCCCCCCC\C=C/CCCCCCCCCCCCO
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CCCC\C=C/CCCCCCCCCCCCO
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CC1C(CC2CC=CC2)CCC1O
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C(CCCCCCCO)=CCCCCCCCO
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C(CCCCCCCCO)=CCCCCCCCCO
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CC1(CC(O)CC1)CC1CC=CC1
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C(CO)CCCCCCC=CCCCCCCCC
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C(CC)=CCCCCCCCCCCO
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C/C(/C)=C/CCC1(C(O)(C)CCC1)C
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CCCCCCCC/C=C\CCCCCCCCO
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C1(CCCCCCC=C)OC1
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C/C(/C)=C/CCC1(C(C)(C)CC1)O
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CCCCCCCCC=CCCCCCCCCCCCCO
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CC1CC(CC/C=C(\C)/C)(O)CC1
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CC1C(C)C(CC/C=C(\C)/C)(O)C1
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C/C(/C)=C/CCC1(CC(C)(C)CC1)O
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C/C(/C)=C/CCC1C(O)CCC1
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CC1C(CC/C=C(\C)/C)(O)CC1
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C/C(/C)=C/CCC1C(O)CCCCC1
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C/C(/C)=C/CCC1(CCCC1)O
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OC1C(CC2CC=CC2)CCCCC1
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CC=C(C(CCCCCC)O)C
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CC(C(C[C@H]1[C@@](O)(C)CCCC1)O)C
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CCC(C(C1C(O)(C)CCCC1)C)O
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CC(CC1C(O)(C)CCCC1)O
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CC(C(CC1C(O)(C)CCCC1)O)C
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C1(CCCCC1CO)CO
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CCC(C[C@H]1[C@@](O)(C)CCCC1)O
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[C@]1(C)(O)CC[C@H](O)CC1
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C1C2CCC(C(CO)C2CO)C1
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CC(C[C@H]1[C@@](O)(C)CCCC1)O
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C1(CO)(CCCCC1)CC(O)(C)C
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C[C@@]12CC[C@@H](O)C(C)(C)[C@@]1([H])CCC1=C[C@@](CC[C@@]21[H])(C)[C@H](CO)O
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C[C@@]12[C@H]3CC=C4[C@H]5CC(C)(C)[C@@H](O)[C@H](O)[C@]5(CO)[C@H](O)C[C@@]4(C)[C@]3(C)CCC1[C@](CO)(C)[C@@H](O)CC2
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CCC(C1C(O)(C)CCCC1)C(O)C
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C12(O)CC=CCC1(C)C1CCC3(C)C(C(C)CCCC(C)C)CCC3C1CC2
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C12(O)CC3CC(C(O)C(C3)C1)C2
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[C@H]1(CO)CCCC[C@@H]1CO
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C1C2(O)CCC(O)(CC2)C1
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C1C2CC3C(O)C(CCO)(C2)CC1C3
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[C@@H]1(CO)CCCC[C@@H]1CO
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C12(C)CCCC(C)(C)C1CCC(C)(O)C2CC(C)(C)O
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CCC(CC1C(O)(C)CCCC1)O
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OC12CC3CC(CC(C3)C1)(CO)C2
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C1C(O)C2CCCC(O)C2CC1
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[C@@H]1(CO)CCCC[C@H]1CO
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C1(CO)C(CO)CCC(C)C1
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C[C@@]1([C@@H](O)CO)C=C2CC[C@@H]3C(C)(C)[C@H](O)CC[C@@]3(C)[C@@H]2CC1
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0.64 |
C12(C)CCCC(C)(C)C1CC[C@@](C)(O)C2CCO
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OC[C@@H]1CCCC[C@H]1CO
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[C@H]1(CO)CCCC[C@@H]1CO
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C1(CCC(C(O)C1)C)C(C)(C)O
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CC(C(C1C(O)(C)CCCC1)C)O
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C12(O)CC3CC4C1CC1CC2C(C3)C4(C1)O
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C1C[C@@]2(CC[C@@H](C(C(=O)O)=C)[C@@H]([C@@]2([H])C(C1)=C)O)C
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CC1(C)C[C@H]2C3=CC[C@@H]4[C@@]5(C)CC[C@H](O)[C@@](C)(CO)[C@@H]5CC[C@@]4(C)[C@]3(C)C[C@H](O)[C@@]2(CO)[C@@H](O)[C@@H]1O
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OC1C2CC3CC1CC(O)(C3)C2
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CC1(C)[C@@H](O)CC[C@@]2(C)[C@@H]3CC[C@@](C)(C=C3CC[C@H]12)C(O)CO
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OC[C@H]1CCCC[C@@H]1CO
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OC[C@@H]1CCCC[C@H]1CO
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OCC12CC3CC(CC(O)(C3)C1)C2
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C[C@@]1(O)CC[C@H](O)CC1
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CC(C)(O)CC1C(C)(O)CCC2C(C)(C)CCCC12C
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CC(O)CCC=C
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CC1(C)CCCC2(C)C(CCO)[C@](C)(O)CCC12
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C[C@]12CC[C@H]3[C@@H](CCC4=C3CC[C@H](O)C4)[C@@H]1CC[C@@H]2O
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C[C@@H](O)CCC=C
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CC1(C)[C@H](O)CC[C@@]2(C)[C@@H]3CC[C@@](C)(C=C3CC[C@H]12)[C@@H](O)CO
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CC(C)(O)CC1(CO)CCCCC1
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CC1(C)CCC[C@]2(C)[C@@H](CCO)[C@](C)(O)CCC12
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CC1(O)CCC(O)CC1
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CC(C)(O)CCC=C
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OC[C@H]1CCCC[C@H]1CO
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CC(C)(O)C[C@@H]1CCCC[C@H]1O
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CC1(C)CCC[C@]2(C)[C@@H](CCO)[C@](C)(O)CC[C@@H]12
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C[C@]12CCCC(=C)[C@@H]1[C@@H](O)[C@@H](CC2)C(=C)C(O)=O
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OC[C@@H]1CCC[C@H](O)C1
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CC(=C)C1CCC2(CC[C@]3(C)C(CCC4[C@@]5(C)CCC(O)C(C)(C)C5CC[C@@]34C)C12)C=O
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CC12CCC3C(CCC4=CCCCC34)C1CCC2O
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CC\C=C\CCCCCCCCCCC[C@@H](O)C[C@@H](O)CO
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[2H]C([2H])([2H])C([2H])([2H])[C@]1(O)CC[C@H]2[C@@H]3CCC4=CCCC[C@@H]4[C@H]3CC[C@]12C
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C[C@@H]1CC[C@]2(C)CC[C@]3(C)C(=CCC4[C@@]5(C)CC[C@@H](O)[C@](C)(CO)C5CC[C@@]34C)[C@@H]2[C@H]1C
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C[C@]12CC[C@H]([C@@H]1[C@H]1CC[C@@H]3[C@@]4(C)CC[C@H](O)C(C)(C)[C@@H]4CC[C@@]3(C)[C@]1(C)CC2)C(=C)C=O
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CC1(C)CC[C@]2(C)CC[C@]3(C)C(=CC[C@@H]4[C@@]5(C)CC[C@H](O)[C@](C)(CO)[C@@H]5CC[C@@]34C)[C@@H]2C1
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| MolPort-023-299-061 |
0.63 |
C[C@]12CC[C@H]([C@@H]1[C@H]1CC[C@@H]3[C@@]4(C)CCC(=O)C(C)(C)[C@@H]4CC[C@@]3(C)[C@]1(C)CC2)C(=C)CO
|
|
| MolPort-003-388-175 |
0.63 |
CC(C)=C1CC2C3CCC4CCCCC4(C)C3CCC2(C)C1O
|
|
| MolPort-039-339-171 |
0.63 |
CC1(C)[C@@H](O)CC[C@@]2(C)[C@H]1CCC1=C2CC[C@@]2(C)[C@@H]3C[C@](C)(CO)CC[C@]3(C)CC[C@]12C
|
|
| MolPort-001-742-411 |
0.63 |
C[C@@]12C[C@]3(CCC4[C@](C)(CO)CCC[C@@]4(C)C3CC1)C=C2
|
|
| MolPort-002-529-788 |
0.63 |
CC1(C)CC[C@]2(C)CC[C@]3(C)C4=C(CC[C@@]3(C)C2C1)[C@@]1(C)CCC(O)C(C)(C)C1CC4
|
|
| MolPort-002-527-314 |
0.63 |
CC1(C)CC[C@]2(C)CC[C@]3(C)C4=C(CC[C@@]3(C)[C@@H]2C1)[C@@]1(C)CC[C@H](O)C(C)(C)C1CC4
|
|
| MCULE-1753922453 |
0.63 |
[H][C@@]12[C@]3(CC[C@]4([C@](C)([C@]3(C)CC[C@@]1(C=O)CC[C@H]2C(=C)C)CC[C@]1([H])[C@@]4(CC[C@@H](C1(C)C)O)C)[H])[H]
|
|
| MCULE-6764818609 |
0.63 |
CC(C(C12CCC(CC1)(N)CC2)O)=C
|
|
| MCULE-5946438019 |
0.63 |
C[C@]12C3[C@@H]([C@@]4([C@@H](CC=3)C(C)(C)[C@H](O)CC4)C)CC[C@]1(C)[C@@H]1[C@@H](C)[C@H](C)CC[C@]1(C)CC2
|
|
| MCULE-4514313259 |
0.63 |
CCCCCCC(O)CC=CCCCCCCCCO
|
|
| MCULE-1038909539 |
0.63 |
C1C[C@]2(C)C3CC=C4[C@]5([H])[C@@H](C)[C@H](C)CC[C@]5(C)CC[C@@]4(C)[C@]3(C)CCC2[C@](CO)(C)[C@@H]1O
|
|
| MCULE-2613547392 |
0.63 |
C/C(/C)=C/C(C12CCCCC1C2)O
|
|
| MCULE-2484766562 |
0.63 |
C1C[C@@]2([C@]3(CC[C@@]4([C@]5([C@H](C(C)=C)CC[C@]5(C=O)CC[C@@]4(C)[C@]3(C)CC[C@@]2([H])C(C)(C)[C@H]1O)[H])[H])[H])C
|
|
| MCULE-1285320299 |
0.63 |
[C@@]12(C)CCC[C@@](C)(CO)C1CC[C@@]13C[C@](C=C1)(C)CCC32
|
|
| MCULE-5296220089 |
0.63 |
C/C(/C)=C/C(C12CCCC1C2)O
|
|
| MCULE-4728128126 |
0.63 |
CC(C1(CCC(O)CC1)N)C=C
|
|
| MCULE-5591347023 |
0.63 |
OC1(C2C(C2)CC1)CC1CC=CC1
|
|
| MCULE-2230836970 |
0.63 |
NC12CCC(C(C=C)O)(CC1)CC2
|
|
| MCULE-7023706443 |
0.63 |
C1C(O)C(C)(C)C2CC=CCC2(C)C1
|
|
| MCULE-4008055942 |
0.63 |
NC1C2(CCC2)C(CCC=C)(O)C1
|
|
| MCULE-7575490689 |
0.63 |
CC(CC(C1(CCCC1)N)O)=C
|
|
| MCULE-4233503518 |
0.63 |
OC1(C2C(C2)CCC1)CC1CC=CC1
|
|
| MCULE-8211700424 |
0.63 |
C(O)(=O)C(C)(CCCC(C)=C)C=C
|
|
| MCULE-1095982134 |
0.63 |
[H]C12CC(O)CCC1(C)C1C=CC3(C)C(CCC3C(C)CCCO)C1CC2
|
|
| MCULE-5924210731 |
0.63 |
CC(CC1(CCC(O)CC1)N)=C
|
|
| MCULE-9336736150 |
0.63 |
NC1(CCC(O)CC1)CCC=C
|
|
| MCULE-3236832984 |
0.63 |
C12(C)C(C(C)CCCO)CCC1C1C(CC2)C2(CCCCC2C=C1)C
|
|
| MCULE-5100609642 |
0.63 |
[C@]12(C)CC[C@@]3([C@@]([H])(CC(CC3)(C)C)[C@]1(C)CCC1[C@@]3(C(C(C)(C)[C@H](CC3)O)CCC2=1)C)C
|
|
| MCULE-6738884794 |
0.63 |
CC(C(C1CCC(N)CC1)O)=C
|
|
| MCULE-2844730204 |
0.63 |
C12(C)CCC3C(CCC4CCCCC34C)C1C/C(=C(/C)\C)/C2O
|
|
| MCULE-2584040890 |
0.63 |
C1C(CO)C(CO)/C/1=C(/C)\C
|
|
| MCULE-8019425107 |
0.63 |
C1C(C(O)C)C=CCC1
|
|
| MCULE-2942289680 |
0.63 |
CCC(CC1(CCC(O)CC1)N)=C
|
|
| MCULE-4780950529 |
0.63 |
[H]C12CCCC=C1CCC1C3CCC(O)C3(C)CCC21
|
|
| MCULE-8309101837 |
0.63 |
C/C(/C)=C/C1(CC2CC(CC2)C1)O
|
|
| MCULE-5147208258 |
0.63 |
C/C(/C)=C/C(C1CC2C(C2)CC1)O
|
|
| MolPort-029-943-150 |
0.63 |
CC1=CCC2C(C)(CO)CCCC2(C)C1CO
|
|
| MolPort-046-790-876 |
0.63 |
OC[C@@H]1C[C@H]1C=C
|
|
| MolPort-000-706-606 |
0.63 |
[Na+].CC1(C)C2CCC(C2)(C([O-])=O)C1=C
|
|
| MolPort-046-697-369 |
0.63 |
C\C1=C\CC(C)(CO)C(O)C2CC2(C)C(O)CC1
|
|
| MolPort-039-338-735 |
0.63 |
C[C@H]([C@H](O)CC=C(C)C)[C@H]1CC[C@@]2(C)C3=C(CC[C@]12C)[C@@]1(C)CC[C@H](O)C(C)(C)C1CC3
|
|
| MolPort-035-706-308 |
0.63 |
CC1(C)CC[C@]2(C)CC[C@]3(C)[C@H]4CC=C5[C@@H](CC[C@H](O)C5(C)C)[C@]4(C)CC[C@@]3(C)[C@@H]2C1
|
|
| MolPort-038-386-697 |
0.63 |
CC1CCC(O)C2(C)CCC(C=C12)C(C)(C)O
|
|
| MolPort-002-511-836 |
0.62 |
CC(O)CC[C@]1(C)CCC(C)=CC1C
|
|
| MolPort-002-511-854 |
0.62 |
CCC(O)CC[C@]1(C)CCC(C)=CC1C
|
|
| MolPort-023-213-102 |
0.62 |
CC(=C)CCCCCCC(O)=O
|
|
| MolPort-023-213-101 |
0.62 |
CC(=C)CCCCCC(O)=O
|
|
| MolPort-044-729-335 |
0.62 |
OCC1CCC\C=C/CC1
|
|
| MolPort-023-213-092 |
0.62 |
OC(=O)CCCCCC=C
|
|
| MolPort-000-153-810 |
0.62 |
OC(=O)CCCCCCCC=C
|
|
| MolPort-006-133-148 |
0.62 |
CC(O)C(C)CCC1CC=C(C)C1(C)C
|
|
| MolPort-006-069-065 |
0.62 |
OC(=O)CCCCCCCCCC=C
|
|
| MolPort-023-213-093 |
0.62 |
OC(=O)CCCCCCC=C
|
|
| MolPort-002-894-354 |
0.62 |
OC(=O)CCCCCCCC(=O)CCCCCCCCC=C
|
|
| MolPort-023-213-100 |
0.62 |
CC(=C)CCCCC(O)=O
|
|
| MolPort-002-507-392 |
0.62 |
OC(=O)CCCCCCCCC=C
|
|
| MolPort-002-507-443 |
0.62 |
CCC(O)CCC1(C)CCC(C)=CC1C
|
|
| MolPort-028-746-650 |
0.62 |
OC(=O)CCCCCCCCCCCCC=C
|
|
| MCULE-2266413616 |
0.62 |
C1CC(O)C2(C)CC2C(C(CC=C1C)(CO)C)O
|
|
| MCULE-2979260832 |
0.62 |
C1CC2(CO)CCCC2(CO)CC=1
|
|
| MCULE-3558306961 |
0.62 |
C(CCCO)(=C)C=C
|
|
| MCULE-4778747911 |
0.62 |
C1C(O)C2(C)CCC(C(O)(C)C)C=C2C(C)C1
|
|
| MCULE-8722569228 |
0.62 |
C1CC2(C)C(CO)C(C)=CCC2C(CO)(C)C1
|
|
| MCULE-7323379876 |
0.62 |
C1C2(CO)CCC2(CO)CC=C1
|
|
| MCULE-9003092096 |
0.62 |
[Na+].C12(CCC(C(C)(C)C1=C)C2)C(=O)[O-]
|
|
| MCULE-1585433326 |
0.62 |
C(O)(C=C)(C1CC1)C1CC1
|
|
| MCULE-6352864696 |
0.62 |
C(O)[C@H](O)CCC=C
|
|
| MCULE-9554247289 |
0.62 |
C1CC2(CO)CC(C)(C)CC2(CO)CC=1
|
|
| MCULE-6863504457 |
0.62 |
O=C(CCCCC(O)=O)CCCCCCCCC=C
|
|
| MCULE-4794081286 |
0.62 |
OC1(CCCCCC1)CC1CC=CC1
|
|
| MCULE-7312598347 |
0.62 |
C/C(/C)=C/C(CC1CCCC1)(O)C
|
|
| MCULE-1748532097 |
0.62 |
CCCC(O)C(=C=C)CCCCCC
|
|
| MCULE-7974840074 |
0.62 |
C(CCCCCCCCC(CCCCCC(O)=O)=O)=C
|
|
| MCULE-7561786019 |
0.62 |
CC1C(C(CC2CC=CC2)O)CCC1
|
|
| MCULE-9057383269 |
0.62 |
CC(C(CC1CC=CC1)O)(O)C
|
|
| MCULE-5407375446 |
0.62 |
CC(C1CCCC1)(CC1CC=CC1)O
|
|
| MCULE-6571932731 |
0.62 |
C=CCCCCCC(=O)O
|
|
| MCULE-1413268524 |
0.62 |
CC1C(CC2CC=CC2)(O)CCC1
|
|
| MCULE-9714012387 |
0.62 |
C(CCCCCCC(=O)O)C(=O)CCCCCCCCC=C
|
|
| MCULE-5586241876 |
0.62 |
C/C(/C)=C/C(C1C(C2CC2)C1)O
|
|
| MCULE-7265382444 |
0.62 |
CCC1C(CC2CC=CC2)(O)CCC1
|
|
| MCULE-1403801057 |
0.62 |
C(CCCCCC(=O)O)CCCCCCC=C
|
|
| MCULE-9313043371 |
0.62 |
CCC1CC(CC2CC=CC2)(O)CC1
|
|
| MCULE-9570282750 |
0.62 |
C/C(/C)=C/C(C1C(C(C)(C)C)C1)O
|
|
| MCULE-3892173219 |
0.62 |
C(CCCCCCCC=C)(O)=O
|
|
| MCULE-6091105789 |
0.62 |
C=C(CCCCCC(=O)O)C
|
|
| MCULE-2839347602 |
0.62 |
CC(C1CCC1)C(/C=C(\C)/C)O
|
|
| MCULE-2215895979 |
0.62 |
C1=C(C)CCC(C)(CCC(CC)O)C1C
|
|
| MCULE-1091603091 |
0.62 |
C1=C(C)CC[C@@](C)(CCC(C)O)C1C
|
|
| MCULE-2837812117 |
0.62 |
C=C(C)CCCCC(=O)O
|
|
| MCULE-1706558387 |
0.62 |
CC1(C(CC2CC=CC2)(O)CCC1)C
|
|
| MCULE-9714691739 |
0.62 |
CC1C(/C=C(\C)/C)(O)CCCCC1
|
|
| MCULE-7928135942 |
0.62 |
C(CCCCCCCCC=C)(O)=O
|
|
| MCULE-9366421620 |
0.62 |
CCC1C(/C=C(\C)/C)(O)CCCCC1
|
|
| MCULE-6567295142 |
0.62 |
C1=CC2C3C4C5C6(C(O)CC5C5CC(O)C26C54)C13
|
|
| MCULE-9740850124 |
0.62 |
O[C@@]1([C@]2([H])[C@@]([C@](CCC(=C2)C(C)C)(C)O)([H])CC1)C
|
|
| MCULE-5041065055 |
0.62 |
[C@@]12([H])CC[C@@](O)(C)[C@@]1([H])C=C(C(C)C)CC[C@]2(O)C
|
|
| MCULE-4436654330 |
0.62 |
C1=CC2C3CC3C1C(CO)C2CO
|
|
| MCULE-6079251175 |
0.62 |
C1CC2(C(O)CC(CC2C(C1)(C)O)C(C(=O)O)=C)C
|
|
| MCULE-3949524970 |
0.62 |
C1=C(C(C)C)CC[C@@](C)(O)C2CC[C@](C)(O)C12
|
|
| MCULE-2870645391 |
0.62 |
C12(C3C4C5C1C=CC5C2(CO)C4C=C3)CO
|
|
| MCULE-8765746285 |
0.62 |
C1C(O)C2(C)CCC(C(C(O)=O)=C)C(O)C2C(C)(O)C1
|
|
| MCULE-6263706719 |
0.62 |
CC(C1CCC(O)(C)C2CCC(O)(C)C2C=1)C
|
|
| MolPort-039-338-152 |
0.62 |
C[C@@]12CCC[C@](C)([C@H]1CC[C@@]13C[C@H](C[C@H](O)[C@@H]21)C(=C)[C@H]3O)C(O)=O
|
|
| MolPort-044-723-271 |
0.62 |
C[C@@]12CCC[C@](C)([C@H]1CC[C@@]13CC(C[C@H](O)[C@@H]21)C(=C)[C@H]3O)C(O)=O
|
|
| MolPort-039-052-288 |
0.62 |
CC(C)C1=C[C@H]2[C@@H](CC[C@]2(C)O)[C@](C)(O)CC1
|
|
| MolPort-019-936-837 |
0.62 |
CC(C)C1=CC2C(CC[C@]2(C)O)[C@](C)(O)CC1
|
|
| MolPort-046-594-421 |
0.62 |
CC(C)C1=CC2C(CCC2(C)O)C(C)(O)CC1
|
|
| MolPort-001-742-167 |
0.62 |
CC1(O)CCCC2(C)C(O)CC(CC12)C(=C)C(O)=O
|
|
| MolPort-001-740-290 |
0.61 |
C\C(CC[C@@H]1[C@@](C)(O)CCC2C(C)(CO)CCC[C@@]12C)=C\CO
|
|
| MolPort-000-146-138 |
0.61 |
C[C@H](CCC=C(C)C)[C@H]1CC[C@@]2(C)C3=C(CC[C@]12C)[C@@]1(C)CC[C@H](O)C(C)(C)[C@@H]1CC3
|
|
| MolPort-046-683-361 |
0.61 |
CC(C)CCC[C@@H](C)[C@H]1CC[C@H]2C3=CC[C@H]4C[C@H](O)CC[C@]4(C)[C@H]3CC[C@]12C
|
|
| MolPort-001-895-260 |
0.61 |
CC1CC2=C(CC1CO)C(C)(C)CCC2
|
|
| MolPort-002-042-108 |
0.61 |
CC1=CCC(CC1)C(C)(C)O
|
|
| MolPort-003-932-718 |
0.61 |
CC1=CC[C@H](CC1)C(C)(C)O
|
|
| MolPort-002-506-872 |
0.61 |
C[C@H](CCC=C(C)C)[C@H]1CC[C@@]2(C)C3=C(CC[C@]12C)[C@@]1(C)CC[C@H](O)C(C)(C)C1CC3
|
|
| MolPort-001-740-292 |
0.61 |
C\C(CC[C@@H]1[C@@](C)(O)CCC2C(C)(C)CCC[C@@]12C)=C\CO
|
|
| MolPort-003-929-356 |
0.61 |
C[C@H]1CCC2=C1C[C@@H](CC[C@@H]2C)C(C)(C)O
|
|
| MolPort-046-687-421 |
0.61 |
CC(C)[C@@H]1CC[C@H]2[C@@]1(C)CC[C@@]1(C)[C@@H]3CC[C@H]4C(C)(C)[C@@H](O)CC[C@]4(C)C3=CC[C@]21C
|
|
| MolPort-046-790-358 |
0.61 |
C[C@@H](CCC=C(C)C)[C@@H]1CC[C@]2(C)C3=C(CC[C@@]12C)[C@@]1(C)CC[C@H](O)C(C)(C)[C@@H]1CC3
|
|
| MolPort-001-740-928 |
0.61 |
C[C@@]12CCC[C@](C)(C1CCC13CC(CCC21)C(=C)C3)C(O)=O
|
|
| MolPort-003-939-209 |
0.61 |
CC1=CC[C@@H](CC1)C(C)(C)O
|
|
| MolPort-002-525-071 |
0.61 |
C\C=C(\CC[C@@H](C)[C@H]1CCC2C3=CC[C@H]4[C@H](C)[C@@H](O)CC[C@]4(C)C3CC[C@]12C)C(C)C
|
|
| MolPort-002-508-554 |
0.61 |
C\C(CC[C@H]1[C@](C)(O)CC[C@H]2C(C)(C)CCC[C@]12C)=C\CO
|
|
| MolPort-002-534-147 |
0.61 |
CC(C)=CCCC(C)(O)C1CCC(C)=CC1
|
|
| MolPort-046-764-422 |
0.61 |
[2H]C([2H])([2H])C(O)(CCC=C(C)C)[C@H]1CCC(C)=CC1.[2H]C([2H])([2H])C(O)(CCC=C(C)C)[C@@H]1CCC(C)=CC1
|
|
| MolPort-009-196-248 |
0.61 |
OC(=O)C1CCC(=C)CC1
|
|
| MolPort-046-793-116 |
0.61 |
CC(C)CCC[C@@H](C)[C@H]1CC[C@H]2C3=CC[C@H]4[C@H](C)[C@H](O)CC[C@]4(C)[C@H]3CC[C@]12C
|
|
| MolPort-023-299-064 |
0.61 |
C\C(CC[C@H]1[C@](C)(O)CC[C@H]2C(C)(C)CCC[C@]12C)=C/CO
|
|
| MolPort-039-338-728 |
0.61 |
C[C@H](CCC=C(C)C)[C@H]1CC[C@@]2(C)C3=CCC4C(C)(C)[C@@H](O)CC[C@]4(C)C3CC[C@]12C
|
|
| MolPort-039-338-516 |
0.61 |
C[C@H](CCC=C(C)C)[C@H]1CC[C@@]2(C)[C@@H]3CCC4C(C)(C)[C@@H](O)CC[C@]4(C)C3=CC[C@]12C
|
|
| MolPort-044-649-696 |
0.61 |
COCC(=C)[C@@H]1CC[C@]2(CO)CC[C@]3(C)[C@H](CC[C@@H]4[C@@]5(C)CC[C@H](O)C(C)(C)[C@@H]5CC[C@@]34C)[C@@H]12
|
|
| MolPort-035-706-381 |
0.61 |
CC(=C)[C@@H]1CC[C@]2(C)CC[C@]3(C)[C@H](CC[C@@H]4[C@@]5(C)[C@H](O)CC(=O)C(C)(C)[C@@H]5CC[C@@]34C)[C@@H]12
|
|
| MolPort-039-242-524 |
0.61 |
CC1=C(C)CC(CC1)C(C)(C)O
|
|
| MolPort-039-194-134 |
0.61 |
CCC(\C=C\C(C)C1CC[C@H]2C3=CC[C@H]4CC(O)CC[C@]4(C)C3CC[C@]12C)C(C)C
|
|
| MolPort-020-015-946 |
0.61 |
CC(C)=CCC[C@@](C)(O)[C@@H]1CCC(C)=CC1
|
|
| MolPort-039-052-710 |
0.61 |
C[C@@]12CCC[C@](C)([C@H]1CC[C@@]13C[C@H](CC[C@@H]21)C(=C)C3)C(O)=O
|
|
| MolPort-027-836-465 |
0.61 |
C[C@H](CCC=C(C)C)[C@@H]1CC[C@]2(C)C3=C(CC[C@@]12C)[C@@]1(C)CC[C@H](O)C(C)(C)[C@@H]1CC3
|
|
| MolPort-039-338-835 |
0.61 |
C\C=C(\CC[C@@H](C)[C@H]1CC[C@H]2C3=CCC4C[C@@H](O)CC[C@]4(C)[C@H]3CC[C@]12C)C(C)C
|
|
| MolPort-044-831-889 |
0.61 |
OC(=O)C1(CCC1)C1(CCC1)C=C
|
|
| MolPort-027-945-607 |
0.61 |
CC(CCC=C(C)C)C1CCC2(C)C3=C(CCC12C)C1CCC(O)C(C)(C)C1CC3
|
|
| MolPort-028-599-898 |
0.61 |
CC1(C)[C@@H](O)CC[C@@]2(C)[C@H]1CC[C@@]1(C)CC3=CC[C@H]4C(C)(C)[C@@H](O)CC[C@]4(C)[C@H]3CC[C@H]21
|
|
| MolPort-028-599-899 |
0.61 |
CC(C)C(=C)CC[C@@H](C)[C@H]1CC[C@@]2(C)C3=C(CC[C@]12C)[C@@]1(C)CC[C@H](O)C(C)(C)[C@@H]1CC3
|
|
| MolPort-029-887-078 |
0.61 |
CC[C@H](\C=C\[C@@H](C)[C@H]1CC[C@H]2C3=CC[C@H]4C[C@@H](O)CC[C@]4(C)[C@H]3CC[C@]12C)C(C)C
|
|
| MolPort-037-962-730 |
0.61 |
OCC1CCCCC=C1
|
|
| MolPort-035-706-287 |
0.61 |
CC(C)[C@@H](C)\C=C\[C@@H](C)[C@H]1CC[C@H]2C3=CC[C@H]4C[C@@H](O)CC[C@]4(C)[C@H]3CC[C@]12C
|
|
| MolPort-035-706-324 |
0.61 |
CC(C)[C@H]1CC[C@H]2[C@@]1(C)CC[C@@]1(C)[C@@H]3CC[C@H]4C(C)(C)[C@@H](O)CC[C@]4(C)C3=CC[C@]21C
|
|
| MolPort-006-169-225 |
0.61 |
CC(CCC=C(C)C)C1CCC2(C)C3=C(CCC12C)C1(C)CCC(O)C(C)(C)C1CC3
|
|
| MolPort-035-706-400 |
0.61 |
CC1(C)[C@@H](O)CC[C@@]2(C)[C@H]1CC[C@@]1(C)CC3=CC[C@H]4C(C)(C)[C@H](O)CC[C@]4(C)[C@H]3CC[C@H]21
|
|
| MolPort-044-723-330 |
0.61 |
C[C@@]12CCC[C@](C)([C@H]1CC[C@@]13C[C@@H](CC[C@@H]21)C(=C)C3)C(O)=O
|
|
| MolPort-044-562-373 |
0.61 |
CC[C@H](CC[C@@H](C)[C@H]1CC[C@H]2C3=CC[C@H]4C[C@@H](O)CC[C@]4(C)[C@H]3CC[C@]12C)C(C)C
|
|
| MolPort-006-123-991 |
0.61 |
CC(C)=CCC[C@](C)(O)[C@H]1CCC(C)=CC1
|
|
| MolPort-004-769-150 |
0.61 |
OC(=O)C1(CC=C)CCCC1
|
|
| MolPort-004-956-484 |
0.61 |
CC(C)CCC[C@@H](C)[C@H]1CC[C@H]2C3=CC[C@H]4C[C@@H](O)CC[C@]4(C)[C@H]3CC[C@]12C
|
|
| MCULE-3958492202 |
0.61 |
[H]C12CCCCC1(C)C1C(O)CC3(C)C(O)CCC3C1CC2
|
|
| MCULE-1281790608 |
0.61 |
[C@]12(C)CC[C@@H](C[C@]1([H])[C@H](O)CC1C3[C@@](C)([C@@](CC3)(C)O)CCC12)O
|
|
| MCULE-8215797692 |
0.61 |
[H]C12CC(O)CCC1(C)C1CCC3(C)CCCC3C1CC2O
|
|
| MCULE-2046557319 |
0.61 |
C1C[C@@](O)(CCO)CC[C@@H]1O
|
|
| MCULE-1295726822 |
0.61 |
C[C@@]1([C@H](CC(C2CC2)O)CCCC1)O
|
|
| MCULE-3005705164 |
0.61 |
C1[C@@]2(C)[C@@]([H])([C@@H](O)C[C@]3([H])[C@]2([H])CC[C@@]2(C)[C@@]3([H])CC[C@@H]2O)C[C@@H](O)C1
|
|
| MCULE-8080062241 |
0.61 |
C12(C)C(O)C(CCO)C(CC1)C2(C)C
|
|
| MCULE-5055648390 |
0.61 |
C1C(O)C2(C)CCC(C(O)(C)C)C(O)C2C(C)C1
|
|
| MCULE-4520792651 |
0.61 |
CC(C(CC1CC=CC1)O)(C)C
|
|
| MCULE-5128156707 |
0.61 |
CC1CC(CC/C=C(\C)/C)(O)C1
|
|
| MCULE-9538281723 |
0.61 |
C/C(/C)=C/CCC1(CC(C)(C)C1)O
|
|
| MCULE-1597597694 |
0.61 |
C/C(/C)=C/CCC1(CCC1)O
|
|
| MCULE-4311460031 |
0.61 |
CC(C(CC1CC=CC1)O)C
|
|
| MCULE-9918110642 |
0.61 |
CCC(C1(CC=CC1)CO)C
|
|
| MCULE-5058412241 |
0.61 |
CC(C(CC1CC=CC1)(O)C)(C)C
|
|
| MCULE-6818941701 |
0.61 |
C1(O)CC2(C)CCC(C(=C)C(=O)O)CC2C(=C)C1
|
|
| MCULE-6265228650 |
0.61 |
C12(C)CCC3C(CC=C4CC(O)CCC34C)C1CCC2C(C)CCC(CC)C(C)C
|
|
| MCULE-9644532124 |
0.61 |
[C@@H]1(O)CC2[C@](C)(CC1)[C@]1([H])[C@]([H])([C@@]3([H])[C@@](CC1)(C)[C@@H]([C@H](C)CCC(O)C(C)C)CC3)CC=2
|
|
| MCULE-8779705243 |
0.61 |
OC(C12CCCC1C2)CC1CCCC=1
|
|
| MCULE-1910237865 |
0.61 |
[C@]12(C)CCC3[C@@]([H])(CC=C4C[C@H](O)CC[C@]34C)C1CC[C@@H]2[C@H](C)CC[C@H](CC)C(C)C
|
|
| MCULE-5776284238 |
0.61 |
C12CC(C=C1)C(CO)C2CO
|
|
| MCULE-7049960827 |
0.61 |
[C@]12(C)CC[C@]3([C@@]([H])(CC=C4C[C@@H](O)CC[C@]34C)[C@]1([H])CC[C@]2([H])[C@]([H])(C)CC[C@@]([H])(CC)C(C)C)[H]
|
|
| MCULE-1747951282 |
0.61 |
C1CC23C=CC(O)([H])C2(CCCC3)CC1
|
|
| MCULE-6039711052 |
0.61 |
C1CC(C)(C)C2[C@](C)(C(O)([C@H](C)CC2)CCC(=CCO)CO)C1
|
|
| MCULE-9379846923 |
0.61 |
C[C@H](CCC[C@H]([C@@H]1[C@]2(C)[C@@]([C@]3([C@@](CC2)([H])[C@]2(C)C(C[C@H](CC2)O)=CC3)[H])([H])CC1)C)CO
|
|
| MCULE-1138072612 |
0.61 |
CCOC1CCC(C(C)=C)(O)CC1
|
|
| MCULE-4587768251 |
0.61 |
[H]C12CC(O)CCC1(C)C1(C)C(O)CC3(C)C(C(C)C=CC(C)C(C)C)CCC3C1=CC2
|
|
| MCULE-1216746738 |
0.61 |
[C@@]12([H])CC[C@H]([C@H](C)CCCC(O)(C)C)[C@@]1(C)CC[C@]1([H])[C@@]3(C)CC[C@H](O)CC3=CC[C@@]21[H]
|
|
| MCULE-5523061914 |
0.61 |
C1(O)CC2[C@](C)(CC1)[C@]1([H])[C@]([H])([C@@]3([H])[C@@](CC1)(C)[C@@H]([C@H](C)[C@H](O)CCC(C)C)CC3)CC=2
|
|
| MCULE-1576185930 |
0.61 |
O[C@@H]1CC[C@@]2(C)C(C1)=CC[C@@H]1[C@@H]2CC[C@]2(C)[C@@H]([C@H](C)CCCC(C)C)CC[C@H]21
|
|
| MCULE-9819330201 |
0.61 |
[C@@]12([H])CC[C@H]([C@H](C)CCC[C@@H](C)CO)[C@@]1(C)CC[C@]1([H])[C@@]3(C)CC[C@H](O)CC3=CC[C@@]21[H]
|
|
| MCULE-6498196947 |
0.61 |
C12C=CC1C1CC(O)C12
|
|
| MCULE-8358015855 |
0.61 |
C1C[C@]2(C)[C@@]3([H])CC[C@]4(C)[C@@]([H])([C@@H](CCCC(C)C)C)CC[C@@]4([H])[C@]3([H])CC=C2C[C@H]1O
|
|
| MCULE-6413140986 |
0.61 |
[C@]12(C)CC[C@]3([C@@]([H])(CC=C4C[C@@H](O)CC[C@]34C)[C@]1([H])CC[C@@H]2[C@H](C)CCCC(C)C)[H]
|
|
| MCULE-5784478301 |
0.61 |
C12(C)CCC3C(CC=C4CC(O)CCC34C)C1CCC2C(C)CCCC(C)C
|
|
| MCULE-1713939889 |
0.61 |
C12CC(O)(C)CCC1(C)C1CCC3(C)C(C(C)CCCC(C)C)CCC3C1CC=2
|
|
| MCULE-2409753351 |
0.61 |
[C@]12(C)CC[C@]3([C@@]([H])(CC=C4C[C@@H](O)CC[C@]34C)[C@]1([H])CC[C@@H]2[C@H](C)CC[C@@H](CC)C(C)C)[H]
|
|
| MCULE-6230328267 |
0.61 |
C1(=CC#N)C2CC3CC1CC(C3)(O)C2
|
|
| MCULE-3433785012 |
0.61 |
CC(C)CC[C@@](O)([C@@](C)([C@]1(CC[C@@]2([C@@]1(CC[C@]1([C@]2(CC=C2[C@@]1(CC[C@](O)(C2)[H])C)[H])[H])C)[H])[H])[H])[H]
|
|
| MCULE-5371407715 |
0.61 |
C12(CCC(C(=C)C1(C)C)C2)C(O)=O
|
|
| MCULE-3896942700 |
0.61 |
C1C[C@]2(C)[C@@]3([H])CC[C@]4(C)[C@@]([H])([C@@H](CCCC(C)CO)C)CC[C@@]4([H])[C@]3([H])CC=C2C[C@H]1O
|
|
| MCULE-9763790385 |
0.61 |
CCOC1CCC(C=C)(O)CC1
|
|
| MCULE-8423145149 |
0.61 |
[C@@]12([H])CC[C@H]([C@H](C)CCCC(O)(C)C)[C@@]1(C)CC[C@]1([H])[C@@]3(C)CC[C@H](O)CC3=CC[C@@]21[H]
|
|
| MCULE-6069203147 |
0.61 |
C1C(C(C)CCCC(C)C)C2(C)CCC3C(CC=C4C3(C)CCC(O)C4(C)C)C2C1
|
|
| MCULE-3817844296 |
0.61 |
OC/C=C(\C)/CC[C@@H]1[C@]2(C)[C@H](C(C)(C)CCC2)CC[C@@]1(C)O
|
|
| MCULE-3259621922 |
0.61 |
C(O)(CC1CCCC(=C)C1)=O
|
|
| MCULE-1052857998 |
0.61 |
NC1C(CC(C=C)O)CCCC1
|
|
| MCULE-1102182553 |
0.61 |
CC1(C(CC=C)O)C(N)CCC1
|
|
| MCULE-4640003531 |
0.61 |
C1C[C@@]2(C)C3C4(CCC2[C@@](C(O)=O)(C)C1)CC(=C)C(CC3)C4
|
|
| MCULE-6692951185 |
0.61 |
[C@@]12(C)CC[C@H]([C@H](C)CC/C=C(/C)\C)[C@@]1(C)CCC1[C@@]3([C@]([H])(C(C)(C)[C@H](CC3)O)CCC2=1)C
|
|
| MCULE-6347475200 |
0.61 |
C(CCCCCC)(C1C=CCCC1)O
|
|
| MCULE-5494176046 |
0.61 |
O[C@H]1CC[C@@]2(C)[C@@H](CC[C@@]3(C)CC4=CC[C@H]5C(C)(C)[C@@H](CC[C@]5(C)[C@H]4CC[C@H]23)O)C1(C)C
|
|
| MCULE-6577726631 |
0.61 |
CC1([C@@]2([H])[C@](C3CC[C@@]4(C)[C@@](C)(CC[C@@H]4[C@@H](CCCC(C)C)C)C=3CC2)(C)CC[C@@H]1O)C
|
|
| MCULE-8948864854 |
0.61 |
C(O)(C)(C)[C@H]1CC=C(C)CC1
|
|
| MCULE-8702483140 |
0.61 |
CC(CC(C1C(N)CCCCC1)O)=C
|
|
| MCULE-3300513366 |
0.61 |
C1(=C)[C@@H]2C[C@@]3(CC[C@H]4[C@@](C)(CCC[C@@]4(C)C(O)=O)[C@@H]3CC2)C1
|
|
| MCULE-2105516503 |
0.61 |
CCOC1CCC(=C)CC1
|
|
| MCULE-7174929038 |
0.61 |
NC1C(C(CC=C)O)CCCCC1
|
|
| MCULE-5486459234 |
0.61 |
OC(C1(CC2(CCC2)C1)CC=C)=O
|
|
| MCULE-4365002802 |
0.61 |
NC1(CCCCC1)CC(C=C)O
|
|
| MCULE-9798755896 |
0.61 |
C1CC(CCC=1C)C(C)(C)O
|
|
| MCULE-8719465843 |
0.61 |
C12(C)CCC([H])(C(C)CC/C=C(\C)/C)C1(C)CCC1C3(C([H])(C(C)(C)C(CC3)O)CCC2=1)C
|
|
| MCULE-1234228131 |
0.61 |
CC(C(CC1(CCCCC1)N)O)=C
|
|
| MCULE-6927409255 |
0.61 |
C12CC[C@@]3([H])C(C)(C)[C@@H](O)CC[C@]3(C)C=1CC[C@]1(C)[C@H](CC[C@@]21C)[C@H](C)CC/C=C(/C)\C
|
|
| MCULE-3174021569 |
0.61 |
OC(=O)[C@]1([C@]2(CC[C@]34C[C@H](C(=C)C3)CC[C@@]4([H])[C@]2(C)CCC1)[H])C
|
|
| MCULE-5892882181 |
0.61 |
CC1CC(C(C=C)O)(N)CCC1
|
|
| MCULE-6240066964 |
0.61 |
C1C(C)=CC[C@H](C(O)(C)C)C1
|
|
| MCULE-2672638007 |
0.61 |
C(O)(C)(C)[C@@H]1CC[C@H](C)C2CC[C@H](C)C=2C1
|
|
| MCULE-8874044879 |
0.61 |
CC1CCC(C(C(C)=C)O)(CN)CC1
|
|
| MCULE-6020208251 |
0.61 |
O[C@@H]1C(C)(C)[C@@]2([H])[C@](C3CC[C@]4(C)[C@@](CC[C@H]4[C@H](C)CC/C=C(/C)\C)(C)C=3CC2)(C)CC1
|
|
| MCULE-1531084364 |
0.61 |
CC(C(C1(CCCCC1)N)O)=C
|
|
| MCULE-7490068037 |
0.61 |
C1(=C)C2CCCC1CC(C(O)=O)C2
|
|
| MCULE-8486046975 |
0.61 |
CC1CC(C(C(C)=C)O)(N)CCC1
|
|
| MCULE-2008595978 |
0.61 |
CC(C(C1CC(N)CCC1)O)=C
|
|
| MCULE-2981002986 |
0.61 |
NC1C2(CCC2)C(CC=C)(O)C1
|
|
| MCULE-7063407467 |
0.61 |
CC(CC(C1(C(N)CCC1)C)O)=C
|
|
| MCULE-5371316798 |
0.61 |
C1C[C@]2(C)[C@@]3([H])CC[C@]4(C)[C@@]([H])([C@@H](/C=C/[C@H](C)C(C)C)C)CC[C@@]4([H])C3=CC[C@@]2([H])C[C@H]1O
|
|
| MCULE-3206249578 |
0.61 |
C1CC(CCC=1C)C(C)(CC/C=C(\C)/C)O
|
|
| MCULE-1647506502 |
0.61 |
CC1CCC(C(C=C)O)(CN)CC1
|
|
| MCULE-8414811975 |
0.61 |
CC(C)([C@H]1CCC(C)=CC1)O
|
|
| MCULE-5456178986 |
0.61 |
OC(=O)[C@]1([C@]2(CC[C@]34C[C@H](C(=C)C3)CC[C@@]4([H])[C@]2(C)CCC1)[H])C
|
|
| MCULE-2778793698 |
0.61 |
C12(C)CCC(C(C)CC/C=C(\C)/C)C1(C)CCC1C3C(C(C)(C)C(CC3)O)CCC2=1
|
|
| MCULE-9520777832 |
0.61 |
C(O)(=O)C1CCC(CC1)=C
|
|
| MCULE-4800437481 |
0.61 |
C1(C(C)(C)C)C(CO)([H])C(CO)([H])C=1C(C)(C)C
|
|
| MCULE-9174314602 |
0.61 |
C1C[C@H](CCC=1C)[C@](C)(CC/C=C(\C)/C)O
|
|
| MCULE-7044206712 |
0.61 |
C1(C(O)C)C(C)=CCCC1
|
|
| MCULE-8699651656 |
0.61 |
C(CCCCC)(CC(CO)CC=C)=CI
|
|
| MCULE-6049121935 |
0.61 |
[H]C12C(C)(CCC(O)C1)C1(CCC3(C)C(C(C)CCC(C)C(C)C)CCC3C1=CC2)[H]
|
|
| MCULE-5127489047 |
0.61 |
C12=CC[C@@]3([C@](C)(CC[C@H](O)[C@H]3C)C1CC[C@]1(C)[C@H](CCC12)[C@H](C)CCC(C(C)C)=CC)[H]
|
|
| MCULE-9808647935 |
0.61 |
[H]C12C(C)(CCC(O)C1)C1(CCC3(C)C(C(C)C=CC(C)C(C)C)CCC3C1=CC2)[H]
|
|
| MCULE-4617598220 |
0.61 |
CC(C1(C(O)=O)CC2(CCC2)C1)C=C
|
|
| MCULE-7021346929 |
0.61 |
NC1(C(CC=C)O)CC2(CCC2)C1
|
|
| MCULE-5502480680 |
0.61 |
CC(C(C1C(N)CCCC1)O)=C
|
|
| MCULE-1327121373 |
0.61 |
CC(CC1(C(O)=O)CC2(CCC2)C1)=C
|
|
| MCULE-5082085003 |
0.61 |
CC(C(C1(CCCCC1)CN)O)=C
|
|
| MCULE-6184897823 |
0.61 |
C(O)(C)(C)[C@@H]1CC=C(C)CC1
|
|
| MCULE-7846055076 |
0.61 |
C1C[C@@]([H])(CCC=1C)[C@@](C)(CC/C=C(/C)\C)O
|
|
| MCULE-1872893741 |
0.61 |
NCC1C(C(C=C)O)CCCC1
|
|
| MCULE-7121840428 |
0.61 |
CC1(C(CC(C2CC2)O)CCCC1)O
|
|
| MCULE-2088220723 |
0.61 |
C12(CO)CCC(C(C)(C)C1CO)C2
|
|
| MCULE-2945137478 |
0.61 |
C1[C@@H](O)[C@]2(C)CC[C@@](O)(C(C)C)C[C@@]2([H])[C@@](C)(O)C1
|
|
| MCULE-5867249126 |
0.61 |
C12CC(O)C3C4C(O)CC5C(C1C53)C24
|
|
| MCULE-5144940139 |
0.61 |
C1C[C@]2(C)[C@@]3([H])CC[C@]4(C)[C@@]([H])([C@@H](CC[C@@H](CC)C(C)C)C)CC[C@@]4([H])[C@]3([H])C[C@H](O)[C@@]2([H])C[C@H]1O
|
|
| MCULE-5989458793 |
0.61 |
C12C3C4C(CO)C(CO)C1C1C2C3C41
|
|
| MCULE-2300530919 |
0.61 |
C1(C)C(O)(CCO)C(C)(C)CC(O)C1
|
|
| MCULE-2874562048 |
0.61 |
C1[C@@H](O)[C@]2(C)CC[C@@H](C(C)C)[C@H](O)[C@@]2([H])[C@@](C)(O)C1
|
|
| MCULE-1135608340 |
0.61 |
[H]C12CC(O)CCC1(C)C1CCC3(C)CC(O)CC3C1CC2O
|
|
| MCULE-9747659186 |
0.61 |
CC1(C(C2C(O)CCC2)CCCC1)O
|
|
| MolPort-046-592-649 |
0.61 |
C[C@]12CC[C@H]3[C@@H](C[C@H](O)[C@H]4C[C@@H](O)CC[C@]34C)[C@@H]1CC[C@@H]2O
|
|
| MolPort-039-338-089 |
0.61 |
CC(C)[C@]1(O)CC[C@@]2(C)[C@H](O)CC[C@](C)(O)[C@@H]2C1
|
|
| MolPort-035-706-226 |
0.61 |
CC(C)[C@@H]1CC[C@@]2(C)[C@H](O)CC[C@](C)(O)[C@@H]2[C@H]1O
|
|
| MolPort-035-706-094 |
0.61 |
OCC[C@@]1(O)CC[C@H](O)CC1
|
|
| MolPort-046-156-495 |
0.61 |
OCC1[C@@H]2CC[C@@H](C2)[C@H]1CO
|
|
| MolPort-038-386-695 |
0.61 |
CC1CCC(O)C2(C)CCC(C(O)C12)C(C)(C)O
|
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| MolPort-038-387-756 |
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OCC1CC(=C)C1
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| MolPort-027-853-635 |
0.61 |
CC1CC(O)CC(C)(C)C1(O)CCO
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| MolPort-039-052-577 |
0.61 |
CC[C@H](CC[C@@H](C)[C@H]1CC[C@H]2[C@@H]3C[C@H](O)[C@H]4C[C@@H](O)CC[C@]4(C)[C@H]3CC[C@]12C)C(C)C
|
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CCC(CO)(CO)CC=C
|
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OCCCCC=C
|
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C[C@@]12CCC[C@H]1[C@@H]1C[C@H](O)[C@H]3C[C@@H](O)CC[C@]3(C)[C@H]1CC2
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CC(C)CCC[C@@H](C)[C@H]1CC[C@H]2[C@@H]3C[C@H](O)[C@H]4C[C@@H](O)CC[C@]4(C)[C@H]3CC[C@]12C
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| MolPort-009-199-147 |
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CC(C)(CO)CCC=C
|
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| MolPort-003-960-121 |
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CC\C=C/CCCCCO
|
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| MolPort-044-560-209 |
0.61 |
C[C@H](CCCC(C)(C)O)[C@H]1CC[C@H]2[C@@H]3CC=C4CC(O)CC[C@]4(C)[C@H]3CC[C@]12C
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CC[C@@H](\C=C\[C@H](C)[C@H]1CC[C@H]2[C@@H]3CC=C4C[C@@H](O)CC[C@]4(C)[C@H]3CC[C@]12C)C(C)C
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CC(C)CCCC(C)C1CCC2C3CC=C4CC(O)CCC4(C)C3CCC12C
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| MolPort-001-740-887 |
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C[C@@H]1CCC2C(C)(C)CCC[C@@]2(C)C1(O)CCC(CO)=CCO
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C[C@H](CCC=C(C)C)[C@H]1CC[C@@]2(C)[C@@H]3CC=C4[C@@H](CC[C@H](O)C4(C)C)[C@]3(C)CC[C@]12C
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0.61 |
CC(C)[C@@H](C)\C=C\[C@@H](C)[C@H]1CC[C@H]2[C@@H]3CC=C4C[C@@H](O)CC[C@]4(C)[C@H]3CC[C@]12C
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C[C@]12CC[C@@H](O)CC1=CC[C@H]1[C@H]3CC[C@H](O)C3CC[C@@H]21
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0.61 |
CC(C)[C@H](C)CC[C@H](C)[C@@H]1CC[C@@H]2[C@@H]3CC=C4C[C@@H](O)CC[C@]4(C)[C@@H]3CC[C@]12C
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CC(C)[C@@H](O)CC[C@@H](C)[C@H]1CC[C@H]2[C@@H]3CC=C4C[C@@H](O)CC[C@]4(C)[C@H]3CC[C@]12C
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0.61 |
CC1(O)CCC2C3CC=C4CC(O)CCC4(C)C3CCC12C
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0.61 |
C[C@H]1[C@H]2C3=CC[C@@H]4[C@@]5(C)CC[C@H](O)C(C)(C)[C@@H]5CC[C@@]4(C)[C@]3(C)C[C@H](O)[C@@]2(C)CCC1=C
|
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| MolPort-000-252-835 |
0.61 |
CC1(C)C(=C)C2CCC1(C2)C(O)=O
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| MolPort-046-764-598 |
0.61 |
[2H]C([2H])(CC(C)[C@@H]1CC[C@@H]2[C@@H]3CC=C4C[C@@H](O)CC[C@]4(C)C3CC[C@]12C)C([2H])(O)C([2H])(C)C
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| MolPort-046-764-571 |
0.61 |
C[C@@H](O)[C@@H]1CC[C@@H]2[C@@H]3CC=C4C[C@@H](O)CC[C@]4(C)[C@@H]3CC[C@]12C
|
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| MolPort-046-773-764 |
0.61 |
[2H]C([2H])([2H])C(CCC[C@@H](C)C1CCC2C3CC=C4C[C@@H](O)CC[C@]4(C)C3CC[C@]12C)C([2H])([2H])[2H]
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0.61 |
[2H]C([2H])([2H])C(O)(CCC[C@@H](C)[C@H]1CC[C@H]2[C@@H]3CC=C4C[C@@H](O)CC[C@]4(C)[C@H]3CC[C@]12C)C([2H])([2H])[2H]
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| MolPort-046-764-597 |
0.61 |
[2H]C([2H])([2H])C([2H])(C(C)CC[C@@H](C)[C@H]1CC[C@H]2[C@@H]3CC=C4C[C@@H](O)CC[C@]4(C)[C@H]3CC[C@]12C)C([2H])([2H])[2H]
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| MolPort-044-183-267 |
0.61 |
C[C@H](CO)CCC[C@@H](C)[C@H]1CC[C@H]2[C@@H]3CC=C4C[C@@H](O)CC[C@]4(C)[C@H]3CC[C@]12C
|
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| MolPort-044-754-061 |
0.61 |
CC[C@@H](CC[C@@H](C)[C@H]1CC[C@H]2[C@@H]3CC=C4C[C@@H](O)CC[C@]4(C)[C@H]3CC[C@]12C)C(C)=C
|
|
| MolPort-042-624-515 |
0.61 |
C[C@@H](CO)CCC[C@@H](C)[C@H]1CC[C@H]2[C@@H]3CC=C4C[C@@H](O)CC[C@]4(C)[C@H]3CC[C@]12C
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| MolPort-044-830-522 |
0.61 |
C\C=C(/CC[C@@H](C)[C@H]1CC[C@H]2[C@@H]3CC=C4C[C@@H](O)CC[C@]4(C)[C@H]3CC[C@]12C)C(C)C
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| MolPort-000-697-037 |
0.61 |
CC(C)CCCC(C)C1CC[C@H]2C3CC=C4CC(O)CCC4(C)[C@H]3CCC12C
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0.61 |
CC(CO)CCC[C@@H](C)[C@H]1CC[C@H]2[C@@H]3CC=C4C[C@@H](O)CC[C@]4(C)[C@H]3CC[C@]12C
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0.61 |
CC(C)C(=C)CC[C@@H](C)[C@H]1CC[C@H]2[C@@H]3CC=C4C[C@@H](O)CC[C@]4(C)[C@H]3CC[C@]12C
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| MolPort-044-755-201 |
0.61 |
C[C@@]12CCC[C@H]1[C@@H]1CC=C3C[C@@H](O)CC[C@]3(C)[C@H]1CC2
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0.61 |
CC(C)[C@H](O)CC[C@@H](C)[C@H]1CC[C@H]2[C@@H]3CC=C4C[C@@H](O)CC[C@]4(C)[C@H]3CC[C@]12C
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0.61 |
CC[C@H](CC[C@@H](C)[C@H]1CC[C@H]2[C@@H]3CC=C4C[C@@H](O)CC[C@]4(C)[C@H]3CC[C@]12C)C(C)C
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| MolPort-044-183-187 |
0.61 |
[2H]C([2H])([2H])C(O)(CCC[C@@H](C)C1CCC2C3CC=C4C[C@@H](O)CC[C@]4(C)C3CC[C@]12C)C([2H])([2H])[2H]
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| MolPort-003-941-119 |
0.61 |
C[C@H](CCC=C(C)C)[C@H]1CC[C@H]2[C@@H]3CC=C4C[C@@H](O)CC[C@]4(C)[C@H]3CC[C@]12C
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| MolPort-035-706-344 |
0.61 |
C[C@H](\C=C\CC(C)(C)O)[C@H]1CC[C@@]2(C)[C@@H]3CC[C@@H]4[C@]5(C[C@@]35CC[C@]12C)CC[C@H](O)C4(C)C
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0.61 |
[2H]C([2H])([2H])C([2H])(C(CC)CC[C@@H](C)[C@H]1CC[C@H]2[C@@H]3CC=C4C[C@@H](O)CC[C@]4(C)[C@H]3CC[C@]12C)C([2H])([2H])[2H]
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| MolPort-035-706-328 |
0.61 |
CC(C)[C@H]1CC[C@@H]2[C@]1(C)CC[C@]1(C)[C@H]3CC=C4[C@@H](CC[C@H](O)C4(C)C)[C@]3(C)CC[C@@]21C
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0.61 |
[2H]C([2H])([2H])C(=CCC[C@@H](C)[C@H]1CC[C@H]2[C@@H]3CC=C4C[C@@H](O)CC[C@]4(C)[C@H]3CC[C@]12C)C([2H])([2H])[2H]
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| MolPort-006-666-182 |
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CCC(CCC(C)C1CCC2C3CC=C4CC(O)CCC4(C)C3CCC12C)C(C)C
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[2H]C([2H])([2H])C([2H])(CCC[C@@H](C)[C@H]1CC[C@H]2[C@@H]3CC=C4C[C@@H](O)CC[C@]4(C)[C@H]3CC[C@]12C)C([2H])([2H])[2H]
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C[C@H](CCCC(C)(C)O)[C@H]1CC[C@H]2[C@@H]3CC=C4C[C@@H](O)CC[C@]4(C)[C@H]3CC[C@]12C
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0.61 |
CC(C)CCC[C@@](C)(O)[C@H]1CC[C@H]2[C@@H]3CC=C4C[C@@H](O)CC[C@]4(C)[C@H]3CC[C@]12C
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| MolPort-046-689-114 |
0.61 |
[2H]C([2H])([2H])C([2H])(C)CCC[C@@H](C)[C@H]1CC[C@H]2[C@@H]3CC=C4C[C@@H](O)CC[C@]4(C)[C@H]3CC[C@]12C
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| MolPort-003-664-628 |
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OCC1C2CC(C=C2)C1CO
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CC(C)[C@@H]1CC[C@@]2(C)CC[C@@]3(C)[C@@H]4CC=C5[C@@H](CC[C@H](O)C5(C)C)[C@]4(C)CC[C@]3(C)[C@@H]12
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CCC(\C=C\C(C)C1CCC2C3CC=C4CC(O)CCC4(C)C3CCC12C)C(C)C
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0.61 |
C[C@H](O)[C@H]1CC[C@H]2[C@@H]3CC=C4C[C@@H](O)CC[C@]4(C)[C@H]3CC[C@]12C
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CC(C)[C@H](C)CC[C@@H](C)[C@H]1CC[C@H]2[C@@H]3CC=C4C[C@@H](O)CC[C@]4(C)[C@H]3CC[C@]12C
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C[C@@H](O)[C@H]1CC[C@H]2[C@@H]3CC=C4C[C@@H](O)CC[C@]4(C)[C@H]3CC[C@]12C
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CCC(\C=C\C(C)[C@H]1CCC2C3CC=C4C[C@@H](O)CC[C@]4(C)C3CC[C@]12C)C(C)C
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CC[C@H](\C=C\[C@@H](C)[C@H]1CC[C@H]2[C@@H]3CC=C4C[C@@H](O)CC[C@]4(C)[C@H]3CC[C@]12C)C(C)C
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CC(C)CC[C@@H](O)[C@@H](C)[C@H]1CC[C@H]2[C@@H]3CC=C4C[C@@H](O)CC[C@]4(C)[C@H]3CC[C@]12C
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[2H]C1=C2C([2H])([2H])[C@@]([2H])(O)C([2H])([2H])C[C@]2(C)[C@H]2CC[C@]3(C)[C@H](CC[C@H]3[C@@H]2C1)[C@H](C)CCCC(C)C
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CC(C)CCC[C@@](C)(O)[C@H]1CC[C@H]2[C@@H]3CC=C4CC(O)CC[C@]4(C)[C@H]3CC[C@]12C
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0.61 |
CC(C)CCC[C@](C)(O)[C@H]1CC[C@H]2[C@@H]3CC=C4C[C@@H](O)CC[C@]4(C)[C@H]3CC[C@]12C
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CC(C)CC[C@H](O)[C@@H](C)[C@H]1CC[C@H]2[C@@H]3CC=C4C[C@@H](O)CC[C@]4(C)[C@H]3CC[C@]12C
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CC[C@@H](\C=C\[C@@H](C)[C@H]1CC[C@H]2[C@@H]3CC=C4C[C@@H](O)CC[C@]4(C)[C@H]3CC[C@]12C)C(C)C
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CC(C)CCC[C@@H](C)[C@H]1CC[C@H]2[C@@H]3CC=C4C[C@@H](O)CC[C@]4(C)[C@H]3CC[C@]12C
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0.61 |
CC(C)CCCC(C)(O)[C@H]1CC[C@H]2[C@@H]3CC=C4C[C@@H](O)CC[C@]4(C)[C@H]3CC[C@]12C
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CC(C)C(O)CCC(C)C1CCC2C3CC=C4CC(O)CCC4(C)C3CCC12C
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CC[C@@H](CC[C@@H](C)[C@H]1CCC2[C@@H]3CC=C4C[C@H](O)CC[C@]4(C)C3CC[C@]12C)C(C)C
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0.61 |
C[C@]1(O)CCC2C3CC=C4C[C@@H](O)CC[C@]4(C)C3CC[C@]12C
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CC(C)[C@@H](C)CC[C@@H](C)[C@H]1CC[C@H]2[C@@H]3CC=C4C[C@@H](O)CC[C@]4(C)[C@H]3CC[C@]12C
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CC1(C)C[C@H]2C3=CC[C@@H]4[C@@]5(C)CC[C@H](O)[C@](C)(CO)[C@@H]5CC[C@@]4(C)[C@]3(C)CC[C@@]2(C)[C@H](O)[C@@H]1O
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[2H]C([2H])([2H])C([2H])(CCCC(C)(O)[C@H]1CC[C@H]2[C@@H]3CC=C4C[C@@H](O)CC[C@]4(C)[C@H]3CC[C@]12C)C([2H])([2H])[2H]
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0.61 |
C[C@]12CC[C@H]3[C@@H](CC=C4C[C@H](O)CC[C@]34C)[C@@H]1CC[C@@H]2O
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CC(C)CCC[C@@H](C)[C@H]1CC[C@H]2[C@@H]3CC=C4CC(O)CC[C@]4(C)[C@H]3CC[C@]12C
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C\C=C(\CC[C@@H](C)[C@H]1CC[C@H]2[C@@H]3CC=C4C[C@@H](O)CC[C@]4(C)[C@H]3CC[C@]12C)C(C)C
|
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OC12CC3CC(C1)C(=CC#N)C(C3)C2
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|
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CC(C)C(O)CC[C@@H](C)[C@H]1CC[C@H]2[C@@H]3CC=C4C[C@@H](O)CC[C@]4(C)[C@H]3CC[C@]12C
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CC12CCC(CC1C(=C)CC(O)C2)C(=C)C(O)=O
|
|
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C[C@]1(O)CCC2[C@@H]3CC=C4C[C@@H](O)CC[C@]4(C)C3CC[C@]12C
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[2H]C([2H])([2H])C(CCC[C@@H](C)[C@H]1CC[C@H]2[C@@H]3CC=C4C[C@@H](O)CC[C@]4(C)[C@H]3CC[C@]12C)C([2H])([2H])[2H]
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[2H]C([2H])([2H])C([2H])(C(O)CC[C@@H](C)[C@H]1CC[C@H]2[C@@H]3CC=C4C[C@@H](O)CC[C@]4(C)[C@H]3CC[C@]12C)C([2H])([2H])[2H]
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[Zn++].[O-]C(=O)CCCCCCCCC=C.[O-]C(=O)CCCCCCCCC=C
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|
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O[C@H]1CCC\C=C/CC1
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CC(O)CC\C=C(/C)CC[C@@H]1C(=C)CCC2C(C)(C)CCC[C@@]12C
|
|
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CC(C)=CCCC(C)(O)C(O)CO
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[K+].[O-]C(=O)CCCCCCCCC=C
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OC1CCCC=CCC1
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C[C@H](CC[C@@H](O)C(C)(C)O)[C@H]1CC[C@@]2(C)[C@@H]3CC=C4[C@@H](CC[C@H](O)C4(C)C)[C@]3(C)[C@H](O)C[C@]12C
|
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OCC1CCCC=C1
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OC(=O)C1CC2(C1)CC(=C)C2
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OC1CCC\C=C/CC1
|
|
| MolPort-006-668-581 |
0.60 |
CC1(C)CCCC2(C)C(CO)C(CO)=CCC12
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|
| MCULE-5304256304 |
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C(=O)(CCCC=C)CCCCCC(=O)O
|
|
| MCULE-5343555845 |
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OC1CC(CC2CC=CCC2)CC1
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|
| MCULE-8741315276 |
0.60 |
C(/C)(\C)=C/CCC(O)(C)C(O)CO
|
|
| MCULE-3597965850 |
0.60 |
CC1(C(CCC=C)(O)CC1N)C
|
|
| MCULE-3707649630 |
0.60 |
C(=O)(C=C)CCCCCC(=O)O
|
|
| MCULE-4979255634 |
0.60 |
C1C2C3C=CC3C(C(CO)C2CO)C=1
|
|
| MCULE-3919531574 |
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C1CC(CCC=1C)C(C)CO
|
|
| MCULE-6061926963 |
0.60 |
C/C(/C)=C/C1(C2(CCCC2)CC1)O
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0.60 |
[C@@H]1(O)C(C2[C@@]([H])(CC1)[C@@]1(C)[C@]([H])([C@]3([C@@](C[C@H]1O)(C)[C@@H]([C@H](C)CC[C@@H](O)C(O)(C)C)CC3)C)CC=2)(C)C
|
|
| MCULE-2997369368 |
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CC1(CC(O)CC1)CC1CC=CCC1
|
|
| MCULE-6807015507 |
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OC1C(CC2CC=CCC2)CCC1
|
|
| MCULE-9051465595 |
0.60 |
C1(C2C=CC(C34C=CC23CC=CC4)C1CO)CO
|
|
| MCULE-8671525222 |
0.60 |
C(CCCCCCCCC=C)(=O)[O-].[K+]
|
|
| MCULE-7610155056 |
0.60 |
C1CC2(C)C(CO)C(CO)=CCC2C(C)(C)C1
|
|
| MCULE-4834307131 |
0.60 |
OC(C1(CCCC1)O)CC1CC=CC1
|
|
| MCULE-7656108129 |
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CC1C(CC2CC=CCC2)CCC1O
|
|
| MCULE-1319972447 |
0.60 |
CC1(C(CC=C)(O)CC1N)C
|
|
