| MolPort-006-391-916 |
1 |
Oc1ccc(cc1O)\[13CH]=[13CH]\[13C](O)=O |
|
| MolPort-006-717-538 |
1 |
OC(=O)C=Cc1ccc(O)c(O)c1 |
|
| MolPort-000-742-954 |
1 |
OC(=O)\C=C\c1ccc(O)c(O)c1 |
|
| MolPort-023-134-755 |
0.94 |
OC(=O)C=Cc1cccc(O)c1 |
|
| MolPort-000-886-288 |
0.94 |
OC(=O)\C=C\c1cccc(O)c1 |
|
| MolPort-023-134-755 |
0.94 |
OC(=O)C=Cc1cccc(O)c1 |
|
| MolPort-002-747-457 |
0.90 |
COC(=O)\C=C\c1ccc(O)c(O)c1 |
|
| MolPort-006-116-270 |
0.89 |
OC(=O)\C=C/c1ccc(O)cc1 |
|
| MolPort-046-418-649 |
0.89 |
C.OC(=O)\C=C\c1ccc(O)cc1 |
|
| MolPort-020-393-194 |
0.89 |
OC(=O)\C=C\c1ccc(O)c(O)c1O |
|
| MolPort-020-393-194 |
0.89 |
OC(=O)\C=C\c1ccc(O)c(O)c1O |
|
| MolPort-046-418-649 |
0.89 |
C.OC(=O)\C=C\c1ccc(O)cc1 |
|
| MolPort-004-288-351 |
0.89 |
OC(=O)C=Cc1ccc(O)cc1 |
|
| MolPort-000-860-894 |
0.89 |
OC(=O)\C=C\c1ccc(O)cc1 |
|
| MolPort-044-723-706 |
0.87 |
CCOC(=O)C=Cc1ccc(O)c(O)c1 |
|
| MolPort-044-723-706 |
0.87 |
CCOC(=O)C=Cc1ccc(O)c(O)c1 |
|
| MolPort-000-490-526 |
0.87 |
COc1ccc(\C=C\C(O)=O)cc1O |
|
| MolPort-003-779-978 |
0.87 |
COc1ccc(C=CC(O)=O)cc1O |
|
| MolPort-046-690-075 |
0.87 |
[2H]C([2H])([2H])Oc1ccc(\C=C\C(O)=O)cc1O |
|
| MolPort-004-787-195 |
0.87 |
CCOC(=O)\C=C\c1ccc(O)c(O)c1 |
|
| MolPort-046-690-075 |
0.87 |
[2H]C([2H])([2H])Oc1ccc(\C=C\C(O)=O)cc1O |
|
| MCULE-3293161796 |
0.86 |
[C@@]12(C)C(=O)C=C[C@@]1([H])[C@H](C)C[C@@]1([H])OC(=O)C(=C)[C@@]1([H])[C@@H]2O |
|
| MCULE-9439093573 |
0.86 |
[C@H]12[C@@H](CC[C@@]3(C)C(C=C[C@@](C)(O)[C@]13[H])=O)[C@@H](C(=O)O2)C |
|
| MCULE-3300544479 |
0.86 |
C1C(=O)[C@@]2(CC[C@]3([H])[C@@H]([C@@]2([H])[C@@](O)(C)C=1)OC(=O)[C@H]3C)C |
|
| MCULE-7025819167 |
0.86 |
C12C(CCC3(C)C(C=CC(C)(O)C13[H])=O)C(C(=O)O2)C |
|
| MolPort-000-490-395 |
0.85 |
COc1cc(\C=C\C(O)=O)ccc1O |
|
| MolPort-011-018-530 |
0.85 |
COc1cc(C=CC(O)=O)ccc1O |
|
| MolPort-022-373-317 |
0.85 |
COC(=O)\C=C\c1cccc(O)c1 |
|
| MolPort-022-373-317 |
0.85 |
COC(=O)\C=C\c1cccc(O)c1 |
|
| MolPort-001-769-475 |
0.85 |
OC(=O)\C=C\c1cc(O)ccc1O |
|
| MCULE-1204198061 |
0.84 |
[C@@H]1([C@@]2([H])[C@](C)([C@@H](OC(=O)C(C)C)[C@@]3([C@H](C)C(=O)O[C@@H]3C1)[H])C(C=C2)=O)C |
|
| MCULE-9566808009 |
0.84 |
[C@]12([H])CC(=O)C(C)=C1C[C@H](C(OC(C)=O)(C)C)C(OC(/C(=C\C)/C)=O)C[C@@H]2C |
|
| MCULE-9744281698 |
0.84 |
[C@@]12(O)CC[C@H]([C@](O)(C)C[C@@H](O)[C@@]3([H])[C@@H](C)OC(=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 |
|
| MolPort-019-994-566 |
0.84 |
[Na+].COc1cc(C=CC([O-])=O)ccc1O |
|
| MolPort-019-994-566 |
0.84 |
[Na+].COc1cc(C=CC([O-])=O)ccc1O |
|
| MolPort-003-986-654 |
0.84 |
[Na+].COc1cc(\C=C\C([O-])=O)ccc1O |
|
| MCULE-2178544437 |
0.83 |
[C@@H]1([C@@]2([H])[C@](C)([C@@H](OC(=O)/C(/C)=C\C)[C@@]3([C@@H](C(=O)O[C@@H]3C1)C)[H])C(C=C2)=O)C |
|
| MCULE-6414357750 |
0.83 |
[C@@H]1([C@@]2([H])[C@](C)([C@@H](OC(=O)C(=C)C)[C@@]3([C@H](C)C(=O)O[C@@H]3C1)[H])C(C=C2)=O)C |
|
| MCULE-1564688046 |
0.82 |
O[C@@H]1C[C@@H]2OC(=O)C[C@@H]2[C@H]1/C=C/[C@@H](O)CCCCC |
|
| MolPort-003-846-822 |
0.82 |
COc1ccc(cc1OC)\[13CH]=[13CH]\[13C](O)=O |
|
| MolPort-004-288-306 |
0.82 |
COc1ccc(C=CC(O)=O)cc1OC |
|
| MolPort-000-489-707 |
0.82 |
COc1ccc(\C=C\C(O)=O)cc1OC |
|
| MolPort-046-158-517 |
0.82 |
Oc1ccc(\C=C\C(=O)OC\C=C\c2ccccc2)cc1O |
|
| MolPort-046-158-517 |
0.82 |
Oc1ccc(\C=C\C(=O)OC\C=C\c2ccccc2)cc1O |
|
| MolPort-028-616-570 |
0.81 |
COc1cccc(\C=C/C(O)=O)c1 |
|
| MolPort-004-288-324 |
0.81 |
COc1cccc(C=CC(O)=O)c1 |
|
| MolPort-000-886-278 |
0.81 |
COc1cccc(\C=C\C(O)=O)c1 |
|
| MolPort-022-377-738 |
0.81 |
CCOC(=O)\C=C\c1cccc(O)c1 |
|
| MolPort-039-338-760 |
0.81 |
Oc1ccc(\C=C\C(=O)OC(=O)\C=C\c2ccc(O)c(O)c2)cc1O |
|
| MolPort-003-848-909 |
0.81 |
COC(=O)\C=C\c1ccc(OC)c(O)c1 |
|
| MolPort-035-749-040 |
0.81 |
COC(=O)C=Cc1ccc(OC)c(O)c1 |
|
| MolPort-009-653-900 |
0.81 |
COC(=O)C=Cc1ccc(O)cc1 |
|
| MolPort-001-760-655 |
0.81 |
COC(=O)\C=C\c1ccc(O)cc1 |
|
| MolPort-019-846-919 |
0.81 |
COC(=O)\C=C/c1ccc(O)cc1 |
|
| MolPort-022-377-738 |
0.81 |
CCOC(=O)\C=C\c1cccc(O)c1 |
|
| MolPort-028-616-570 |
0.81 |
COc1cccc(\C=C/C(O)=O)c1 |
|
| MolPort-039-338-760 |
0.81 |
Oc1ccc(\C=C\C(=O)OC(=O)\C=C\c2ccc(O)c(O)c2)cc1O |
|
| MolPort-035-749-040 |
0.81 |
COC(=O)C=Cc1ccc(OC)c(O)c1 |
|
| MCULE-3574561675 |
0.80 |
C1[C@]2(C)[C@@]3([H])[C@H](O)C[C@]4(C)[C@]5(CCC(=O)O5)CC[C@@]4([H])[C@]3([H])[C@H](C(OC)=O)CC2=CC(=O)C1 |
|
| MCULE-8024539765 |
0.80 |
O=C(OC)[C@H]1[C@]2([H])[C@@]([C@@H](C[C@]3([C@@]2([H])CC[C@]23CCC(=O)O2)C)O)([H])[C@]2(C)C(=CC(=O)CC2)C1 |
|
| MCULE-5303288459 |
0.80 |
C12C=C(C)C(=O)C1(O)CC(CO)=CC1C3C(C)(C)C3(OC(CCCCCCCCCCC)=O)CC(C)C12O |
|
| MCULE-4155630515 |
0.80 |
[C@@H]1([C@@]2([H])[C@](C)(C(OC(=O)C(=C)C)[C@@]3(C(=C)C(=O)O[C@@H]3C1)[H])C(C=C2)=O)C |
|
| MCULE-6004210718 |
0.80 |
C12(C)CC(O)C3C(C(C(OC)=O)CC4=CC(=O)CCC43C)C1CCC12CCC(=O)O1 |
|
| MCULE-3861744236 |
0.80 |
C12C=C(C)C(=O)[C@@]1(O)CC(CO)=C[C@@]1([H])[C@]3([H])C(C)(C)[C@]3(OC(CCCCCCCCCCCCCCC)=O)C[C@@H](C)[C@@]12O |
|
| MolPort-019-904-823 |
0.80 |
COc1cc(C=CC(O)=O)cc(OC)c1O |
|
| MolPort-046-773-929 |
0.80 |
[K+].COc1cccc(\C=C\C([O-])=O)c1 |
|
| MolPort-019-904-823 |
0.80 |
COc1cc(C=CC(O)=O)cc(OC)c1O |
|
| MolPort-001-786-899 |
0.80 |
COC(=O)\C=C\c1ccc(O)c(OC)c1 |
|
| MolPort-009-674-147 |
0.80 |
COC(=O)C=Cc1ccc(O)c(OC)c1 |
|
| MolPort-000-154-620 |
0.80 |
COc1cc(\C=C\C(O)=O)cc(OC)c1O |
|
| MolPort-046-509-643 |
0.80 |
CCOc1cc(C=CC(O)=O)ccc1O |
|
| MolPort-046-773-929 |
0.80 |
[K+].COc1cccc(\C=C\C([O-])=O)c1 |
|
| MolPort-046-509-643 |
0.80 |
CCOc1cc(C=CC(O)=O)ccc1O |
|
| MCULE-8753646114 |
0.79 |
[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-8782047011 |
0.79 |
[C@@]12(OC(=O)C)C[C@H]([C@]3(O)[C@]4([H])C=C(C)C(=O)[C@]4(CC(CO)=C[C@@]3([H])[C@]1([H])C2(C)C)O)C |
|
| MCULE-9439877737 |
0.79 |
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-3716742475 |
0.79 |
[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 |
|
| MolPort-002-800-641 |
0.79 |
OC(=O)C(=Cc1ccc(O)cc1)C(O)=O |
|
| MolPort-000-655-960 |
0.79 |
COc1ccc(\C=C\C(O)=O)cc1 |
|
| MolPort-000-860-921 |
0.79 |
COc1ccc(C=CC(O)=O)cc1 |
|
| MolPort-001-769-474 |
0.79 |
OC(=O)\C=C\c1ccc(O)cc1O |
|
| MolPort-022-373-335 |
0.79 |
CC(=O)\C=C\c1ccc(O)c(O)c1 |
|
| MolPort-022-373-335 |
0.79 |
CC(=O)\C=C\c1ccc(O)c(O)c1 |
|
| MolPort-035-682-954 |
0.78 |
CCOC(=O)\C=C\c1ccc(OC)c(O)c1 |
|
| MolPort-002-886-914 |
0.78 |
CCOC(=O)\C=C\c1ccc(O)cc1 |
|
| MolPort-027-639-261 |
0.78 |
CCOC(=O)C=Cc1ccc(O)cc1 |
|
| MolPort-004-929-119 |
0.78 |
COc1ccc(\C=C\C(O)=O)c2ccccc12 |
|
| MolPort-001-641-053 |
0.78 |
OC(=O)\C=C\c1ccccc1O |
|
| MolPort-035-682-954 |
0.78 |
CCOC(=O)\C=C\c1ccc(OC)c(O)c1 |
|
| MolPort-027-639-261 |
0.78 |
CCOC(=O)C=Cc1ccc(O)cc1 |
|
| MolPort-019-937-164 |
0.78 |
COC\C=C\c1ccc(O)c(O)c1 |
|
| MCULE-1536474229 |
0.78 |
O=C(C1CCCCCC=1)OCC1COCC1 |
|
| MCULE-8297229450 |
0.78 |
C12C[C@H]3[C@@H](C[C@H](C)[C@]1([H])CC(=O)C=2C)OC(=O)C3=C |
|
| MCULE-3423268424 |
0.78 |
C1CC(C)=CC(O)C2C(=C)C(=O)OC2CC(=C)C1O |
|
| MCULE-5000124600 |
0.78 |
[C@@]1([H])([C@@H](C(C)C)CC[C@@]2(O)COC(=O)[C@@]12[H])/C=C(\CO)/C(O)=O |
|
| MolPort-006-109-312 |
0.78 |
OC(=O)C=Cc1ccccc1O |
|
| MolPort-019-937-164 |
0.78 |
COC\C=C\c1ccc(O)c(O)c1 |
|
| MolPort-003-741-923 |
0.78 |
COc1ccc(\C=C(/C)C(O)=O)cc1OC |
|
| MolPort-004-288-326 |
0.77 |
COc1cc(C=CC(O)=O)cc(OC)c1OC |
|
| MolPort-000-685-197 |
0.77 |
COc1cc(\C=C\C(O)=O)cc(OC)c1OC |
|
| MolPort-003-665-677 |
0.77 |
Oc1ccc(\C=C\C=O)cc1 |
|
| MolPort-027-631-768 |
0.77 |
Oc1ccc(C=CC=O)cc1 |
|
| MolPort-001-763-851 |
0.77 |
CCOC(=O)\C=C\c1ccc(O)c(OC)c1 |
|
| MolPort-000-183-089 |
0.77 |
CCOc1ccc(\C=C\C(O)=O)cc1OC |
|
| MolPort-009-021-706 |
0.77 |
COC(=O)C=Cc1ccc(OC)c(OC)c1 |
|
| MolPort-019-904-624 |
0.77 |
CCOC(=O)C=Cc1ccc(O)c(OC)c1 |
|
| MolPort-042-624-480 |
0.77 |
OC(=O)\C=C\c1ccc(O)c(O)c1\C=C\c1ccc(O)c(O)c1 |
|
| MolPort-001-512-009 |
0.77 |
COC(=O)\C=C\c1ccc(OC)c(OC)c1 |
|
| MolPort-003-726-796 |
0.77 |
CCOc1ccc(C=CC(O)=O)cc1OC |
|
| MolPort-027-722-529 |
0.77 |
COc1cccc(C=C(C)C(O)=O)c1 |
|
| MolPort-009-019-298 |
0.77 |
COC(=O)\C=C/c1cc(O)ccc1O |
|
| MolPort-000-147-441 |
0.77 |
CCOc1cccc(\C=C\C(O)=O)c1 |
|
| MolPort-003-848-860 |
0.77 |
COC(=O)\C=C\c1cc(O)ccc1O |
|
| MolPort-044-559-799 |
0.77 |
COc1cc(O)cc(\C=C\C(O)=O)c1 |
|
| MolPort-042-624-480 |
0.77 |
OC(=O)\C=C\c1ccc(O)c(O)c1\C=C\c1ccc(O)c(O)c1 |
|
| MolPort-019-904-624 |
0.77 |
CCOC(=O)C=Cc1ccc(O)c(OC)c1 |
|
| MolPort-027-722-529 |
0.77 |
COc1cccc(C=C(C)C(O)=O)c1 |
|
| MolPort-044-559-799 |
0.77 |
COc1cc(O)cc(\C=C\C(O)=O)c1 |
|
| MolPort-027-631-768 |
0.77 |
Oc1ccc(C=CC=O)cc1 |
|
| MCULE-3968820569 |
0.77 |
C1=CC2CC3OC(=O)C4C3C2C1C4C(OC)=O |
|
| MCULE-7914276135 |
0.77 |
C1=CC2([H])CC3([H])OC(=O)C4([H])C3([H])C2([H])C1([H])C4C(O)=O |
|
| MCULE-5531778494 |
0.77 |
[C@@]12(CCC(=O)O1)CCC1C3[C@H](C(=O)OC4CCCC4)CC4=CC(CCC4(C)C3CCC21C)=O |
|
| MCULE-3797371394 |
0.77 |
O=C1CCC2(C)C3C(O)CC4(C)C(O)(CCC4C3CC(O)C2=C1)C(COC(C)=O)=O |
|
| MCULE-7503740182 |
0.77 |
C(=O)(OC1CC(C)CCC1C(C)C)C1CCC(C(=O)OC2CC(C)CCC2C(C)C)CC=1 |
|
| MCULE-9605632489 |
0.77 |
C12C(=O)C=C(CO)[C@]1([H])[C@H]1OC(=O)[C@H](C)[C@]1([H])[C@@H](O)CC=2C |
|
| MCULE-1777552821 |
0.77 |
C[C@]12CC[C@]3([H])[C@]4(CCC(=O)C=C4C[C@@H](C(=O)OC(C)C)[C@@]3([H])[C@]1([H])CC[C@]12CCC(=O)O1)C |
|
| MolPort-000-492-413 |
0.76 |
COc1cc(\C=C\C(O)=O)ccc1OC(C)C |
|
| MolPort-005-220-311 |
0.76 |
CCOc1ccc(C=CC(O)=O)cc1OCC |
|
| MolPort-005-934-262 |
0.76 |
COc1cc(\C=C\C(=O)OC(C)C)ccc1O |
|
| MolPort-019-923-431 |
0.76 |
OC(=O)C(=C/c1cccc(O)c1)\C#N |
|
| MolPort-000-490-638 |
0.76 |
CCOc1cc(\C=C\C(O)=O)ccc1OC |
|
| MolPort-005-220-398 |
0.76 |
COc1cc(C=CC(O)=O)ccc1OC(C)C |
|
| MolPort-000-490-608 |
0.76 |
CCOc1ccc(\C=C\C(O)=O)cc1OCC |
|
| MolPort-001-793-003 |
0.76 |
OC(=O)C(=C\c1cccc(O)c1)\C#N |
|
| MolPort-027-637-461 |
0.76 |
COC(=O)\C=C\c1cccc(OC)c1 |
|
| MolPort-035-785-071 |
0.76 |
[Na+].COc1cc(\C=C\C([O-])=O)cc(OC)c1OC |
|
| MolPort-000-147-556 |
0.76 |
COc1cc(OC)cc(\C=C\C(O)=O)c1 |
|
| MolPort-004-365-068 |
0.76 |
COc1cc(OC)cc(C=CC(O)=O)c1 |
|
| MolPort-023-278-996 |
0.76 |
NC(=O)\C=C\c1ccc(O)c(O)c1 |
|
| MolPort-003-760-254 |
0.76 |
COc1cccc(\C=C\C(O)=O)c1O |
|
| MolPort-009-674-075 |
0.76 |
CCOc1ccc(C=CC(O)=O)cc1 |
|
| MolPort-000-145-653 |
0.76 |
CCOc1ccc(\C=C\C(O)=O)cc1 |
|
| MolPort-027-637-461 |
0.76 |
COC(=O)\C=C\c1cccc(OC)c1 |
|
| MolPort-009-649-138 |
0.76 |
CC(C)Oc1cccc(\C=C\C(O)=O)c1 |
|
| MolPort-023-278-996 |
0.76 |
NC(=O)\C=C\c1ccc(O)c(O)c1 |
|
| MolPort-019-923-431 |
0.76 |
OC(=O)C(=C/c1cccc(O)c1)\C#N |
|
| MolPort-035-785-071 |
0.76 |
[Na+].COc1cc(\C=C\C([O-])=O)cc(OC)c1OC |
|
| MCULE-3117365017 |
0.76 |
CC1[C@@H]2[C@H]3OC(=O)[C@]4([C@@]5(C)[C@H]6[C@@H]7OC(=O)C(=C)[C@@H]7CC[C@](O)(C)[C@@]6(C=C5)C4)[C@@H]3[C@@H](OC(C)=O)C[C@](O)(C)[C@@H]2CC=1 |
|
| MCULE-2588682863 |
0.76 |
C1C(OC(=O)C(C)(C)C(C(O)C=CC1O)O)CC(CCC)O |
|
| MCULE-8131321980 |
0.76 |
C1(=C[C@]2([H])[C@H](C)C(C)=CC32[C@]1(COC(=O)[C@@]3(CO)O)[H])C(O)=O |
|
| MCULE-1873003390 |
0.76 |
C12(CC34C(C5C(CCC3(C)O)C(C(=O)O5)=C)C1(C)C=C4)C(=O)OC1C3C(C)=CCC3C(C)(O)CC(OC(C)=O)C21 |
|
| MCULE-6697936504 |
0.76 |
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-8538526232 |
0.76 |
O(C(C)=O)C12C(C)(C)C1C1C(O)(C(C)C2O)C2C=C(C)C(C2CC(CO)=C1)=O |
|
| MCULE-4528371133 |
0.76 |
C12(O)CC(CO)=CC3C4C(C)(C)C4(OC(=O)C(CC)CC)C(OC(=O)C(C)C)C(C)C3(O)C1C=C(C)C2=O |
|
| MCULE-5162561663 |
0.76 |
C12=CC(=O)[C@]3([C@](C)(CC([C@H](O)C3)O)C1CC[C@]1(C)C(CC[C@@]21O)[C@@](C)(O)[C@H](OC(C)=O)CC1C(C)OC(=O)C1C)[H] |
|
| MCULE-1800748634 |
0.76 |
C12(C=C(C(C1(CC(=CC1(C3([H])C(C)(C)C3(OC(=O)C)C(OC(CCCCCCCCCCCCC)=O)C(C)C12O)[H])CO)O)=O)C)[H] |
|
| MCULE-1325545503 |
0.76 |
[C@]12([H])[C@@]3(O)[C@H](C)[C@@H](OC(CCCCCCCCCCCCC)=O)[C@@]4(OC(=O)C)C(C)(C)[C@H]4[C@]3([H])C=C(CO)C[C@]1(O)C(=O)C(C)=C2 |
|
| MCULE-9996588512 |
0.76 |
C12(O)CC(CO)=CC3C4C(C)(C)C4(OC(=O)C(C)CC)C(OC(=O)C)C(C)C3(O)C1C=C(C)C2=O |
|
| MCULE-8738789658 |
0.76 |
[C@]12(OC(=O)CCC)C(C)(C)[C@H]1[C@]1([H])C=C(CO)C[C@]3(O)C(C(C)=C[C@@]3([H])[C@@]1(O)[C@H](C)[C@H]2OC(=O)CCC)=O |
|
| MCULE-9544869308 |
0.76 |
C(O[C@@H]1[C@@H](C)[C@@]2(O)[C@]([H])([C@]3([H])C(C)(C)[C@@]31OC(C)=O)C=C(CO)C[C@@]1(O)[C@@]2([H])C=C(C)C1=O)(=O)CCCCCCCCCCCCC |
|
| MolPort-002-370-552 |
0.75 |
CCOc1ccc(\C=C\C(O)=O)c2ccccc12 |
|
| MolPort-044-175-466 |
0.75 |
COc1ccc2cc(\C=C\C([O-])=O)ccc2c1 |
|
| MolPort-001-838-130 |
0.75 |
COc1ccc(\C=C\C(O)=O)c(C)c1 |
|
| MolPort-046-623-610 |
0.75 |
COc1ccc2cc(C=CC(O)=O)ccc2c1 |
|
| MolPort-044-175-466 |
0.75 |
COc1ccc2cc(\C=C\C([O-])=O)ccc2c1 |
|
| MolPort-038-092-919 |
0.75 |
COc1ccc(\C=C(\C)C(O)=O)cc1 |
|
| MolPort-022-394-893 |
0.75 |
COC(=O)\C=C\c1cc(OC)c(O)c(OC)c1 |
|
| MolPort-046-623-610 |
0.75 |
COc1ccc2cc(C=CC(O)=O)ccc2c1 |
|
| MolPort-001-786-889 |
0.75 |
COc1cc(\C=C\C=O)ccc1O |
|
| MolPort-011-242-576 |
0.75 |
OC(=O)C=Cc1cccc(Oc2ccccc2)c1 |
|
| MolPort-001-760-440 |
0.75 |
OC(=O)\C=C\c1cccc(Oc2ccccc2)c1 |
|
| MolPort-016-540-708 |
0.75 |
COc1ccc(\C=C\C(O)=O)cc1OC(C)C |
|
| MolPort-000-886-557 |
0.75 |
CCOc1cc(\C=C\C(O)=O)ccc1OC(C)C |
|
| MolPort-002-469-088 |
0.75 |
COc1ccc2cc(\C=C\C(O)=O)ccc2c1 |
|
| MolPort-000-148-249 |
0.75 |
CC(C)Oc1ccc(\C=C\C(O)=O)cc1 |
|
| MolPort-005-229-321 |
0.75 |
CC(C)Oc1ccc(C=CC(O)=O)cc1 |
|
| MolPort-038-092-919 |
0.75 |
COc1ccc(\C=C(\C)C(O)=O)cc1 |
|
| MolPort-002-691-402 |
0.75 |
CC(C)Oc1ccc(\C=C\C([O-])=O)cc1 |
|
| MolPort-022-394-893 |
0.75 |
COC(=O)\C=C\c1cc(OC)c(O)c(OC)c1 |
|
| MolPort-001-765-950 |
0.75 |
CCOC(=O)\C=C\c1ccc(OC)c(OC)c1 |
|
| MolPort-003-741-913 |
0.75 |
COc1ccc(\C=C(/C)C(O)=O)cc1 |
|
| MCULE-6534243824 |
0.75 |
C1=CC2C3C=C(C(=O)OC)C3C1C1C(=O)OC(=O)C12 |
|
| MCULE-6089943254 |
0.75 |
C1(=O)O[C@H](C)CCCC=C[C@@]2([H])CC(=O)C[C@]2([H])[C@@H](O)C=C1 |
|
| MCULE-2662745028 |
0.75 |
C[C@@]12[C@H]3C(C=C4[C@@H]5C[C@@]6(C)C(=O)O[C@@H]([C@]5(C)CC[C@@]4(C)[C@]3(C)CC[C@H]1C(C)(C)[C@@H](O)CC2)C6)=O |
|
| MCULE-1244370752 |
0.75 |
C1(CC2CC1C=C2)C(OCCCCOC(C1CCC=CC1)=O)=O |
|
| MCULE-6415597267 |
0.75 |
[C@]12(C)C[C@@H](OC(C)=O)[C@]3([C@@]([H])(CCC4=CC(=O)CC[C@]34C)[C@]1([H])CC[C@]2(O)C(=O)COC(C)=O)[H] |
|
| MCULE-6317774895 |
0.75 |
C(C)(=O)OC1CCC23C4CCC5(C)C(C6COC(C=6)=O)CCC5C4(CCC2(O)C1)OC3=O |
|
| MCULE-2994624081 |
0.75 |
[C@@]12(C)C(C(C)=O)CCC1C1C([C@H](OC(CCC(O)=O)=O)C2)[C@@]2(C)CCC(C=C2CC1)=O |
|
| MCULE-2127723525 |
0.74 |
[C@]12(C)C[C@@H]([C@]3([H])[C@@]4(C)CCC(=O)C=C4CC[C@@]3([H])[C@]1([H])CC[C@]2(O)C(=O)COC(=O)CCC(=O)O)O |
|
| MCULE-7055938722 |
0.74 |
O=C1C23C4CCC5(C)C(C6COC(C=6)=O)CCC5(C4(CCC2(O)CC(O)CC3)O1)[H] |
|
| MCULE-2014190393 |
0.74 |
C(C)(=O)OC1CCC2(C3CCC4(C)C(C5COC(C=5)=O)CC=C4C3CCC2(O)C1)C(O)=O |
|
| MCULE-4115143726 |
0.74 |
O[C@@H]1C(=C(C)C[C@@]2([H])OC(=O)C(=C)[C@@]12[H])[C@@H](C)CCCO |
|
| MCULE-2277162868 |
0.74 |
[C@@]123C=C[C@@H](C(C(=O)O1)(C)[C@@]2([H])[C@@H]([C@@]12CC([C@](C1)(O)CC[C@]23[H])=C)C(O)=O)O |
|
| MCULE-9489909920 |
0.74 |
C12(C)CC(OC(C)=O)C3C(CCC4=CC(=O)CCC34C)C1CC[C@]2(OC(C)=O)C(=O)COC(C)=O |
|
| MCULE-2235884727 |
0.74 |
C1=C[C@]23OC(=O)[C@@](C)([C@@]2([H])[C@H](C(O)=O)[C@]24C[C@]([H])(C(=C)C2)CC[C@]43[H])[C@H]1O |
|
| MCULE-2203626367 |
0.74 |
C1(C)CC2OC(=O)C(=C)C2C(O)C=1C(C)CCCO |
|
| MCULE-2019795890 |
0.74 |
C12(C)CC(OC(C)=O)C3C(CCC4=CC(=O)CCC34C)C1CCC2(OC(C)=O)C(=O)COC(C)=O |
|
| MCULE-8845052705 |
0.74 |
C12C(=O)OC(=O)C1C1C=CC2(C)O1 |
|
| MCULE-3099268900 |
0.74 |
C12CC(C)(C)CC31C(O)(CO)C(=O)OCC3C(C(O)=O)=C2 |
|
| MCULE-2616985564 |
0.74 |
[C@]12(C)CC(O)C3C(CCC4=CC(=O)CC[C@]34C)C1CC[C@]2(O)C(=O)COC(CCC(O)=O)=O |
|
| MCULE-7864191553 |
0.74 |
[C@H]12OC(=O)C(=C)[C@H]1[C@H](O)C([C@@H](C)CCCOC(=O)C)=C(C)C2 |
|
| MCULE-5448913970 |
0.74 |
[C@@]123C=C[C@@H]([C@@](C(=O)O1)(C)[C@@]2([H])[C@@H]([C@@]12CC([C@](C1)(O)CC[C@]23[H])=C)C(O)=O)O |
|
| MCULE-3859706810 |
0.74 |
[H][C@]12[C@@]3(CCC4[C@@](C)([C@@]3([H])[C@@H](O)C[C@]1(C)[C@](C(CO)=O)(OC(CCC)=O)CC2)CCC(=O)C=4)[H] |
|
| MCULE-7118099436 |
0.74 |
C(C)(=O)OC1CCC2(C3CCC4(C)C(C5COC(C=5)=O)CC=C4C3CCC2(O)C1)C=O |
|
| MCULE-9425225826 |
0.74 |
C1(C)CC23CCCCCC2(C(=O)OC3=O)CC=1 |
|
| MCULE-9169992682 |
0.74 |
C123C=CC(C(C(=O)O1)(C)C2C(C12CC(C(C1)(O)CCC23)=C)C(O)=O)O |
|
| MCULE-2356589109 |
0.74 |
C12(C)CC(O)C3C(CCC4=CC(=O)CCC34C)C1CCC2(OC(C)=O)C(CO)=O |
|
| MCULE-2103729807 |
0.74 |
C12(C)CC(O)C3(C([H])(CCC4=CC(=O)CCC34C)C1([H])CCC2(O)C(=O)COC(CCC(O)=O)=O)[H] |
|
| MCULE-5041290339 |
0.74 |
C12(C)CC(O)C3C(CCC4=CC(=O)CCC34C)C1CCC2(OC(CCC)=O)C(CO)=O |
|
| MCULE-4824233854 |
0.74 |
C1(O)C=CC(O)CCC(=O)OC(C1O)CCCCCCC |
|
| MCULE-9013163041 |
0.74 |
[C@@]123C=C[C@@H](C(C(=O)O1)(C)[C@@]2([H])[C@@H]([C@@]12CC([C@](C1)(O)CC[C@]23[H])=C)C(O)=O)O |
|
| MCULE-6952577518 |
0.74 |
C[C@@]12[C@](C(=O)COC(=O)CCC(=O)O)(O)CC[C@H]1[C@@H]1CCC3=CC(=O)CC[C@]3(C)[C@@H]1[C@@H](O)C2 |
|
| MCULE-3492234187 |
0.74 |
O(C1(CCC2([H])C3([H])CCC4=CC(=O)CCC4(C)C3([H])C(O)CC12C)C(=O)CO)C(=O)CCCC |
|
| MCULE-7005966850 |
0.74 |
O=C(CCC(=O)OCC(=O)[C@@]1([C@]2(C)[C@@]([C@]3([C@@]([C@H](C2)O)([H])[C@]2(C)C(=CC(=O)CC2)CC3)[H])([H])CC1)O)O |
|
| MCULE-5099122669 |
0.74 |
[C@]12(C)C[C@@H](O)[C@]3([C@@]([H])(CCC4=CC(=O)CC[C@]34C)[C@]1([H])CC[C@]2(OC(C)=O)C(CO)=O)[H] |
|
| MCULE-5494151913 |
0.74 |
C1=CC23OC(=O)C(C)(C2([H])C(C(O)=O)C24CC([H])(C(=C)C2)CCC43[H])C1O |
|
| MolPort-003-760-257 |
0.74 |
OC(=O)C=Cc1ccccc1 |
|
| MolPort-046-158-520 |
0.74 |
Oc1ccc(\C=C\C(=O)OC\C=C\c2ccccc2)cc1 |
|
| MolPort-025-405-239 |
0.74 |
COc1ccc(C=CCO)cc1O |
|
| MolPort-027-631-802 |
0.74 |
OCC=Cc1ccc(O)cc1 |
|
| MolPort-046-764-384 |
0.74 |
O[13C](=O)\[13CH]=[13CH]\c1ccccc1 |
|
| MolPort-046-683-461 |
0.74 |
C.OC(=O)\C=C\c1ccccc1 |
|
| MolPort-028-616-992 |
0.74 |
OC(=O)\C=C/c1ccccc1 |
|
| MolPort-027-631-802 |
0.74 |
OCC=Cc1ccc(O)cc1 |
|
| MolPort-046-683-461 |
0.74 |
C.OC(=O)\C=C\c1ccccc1 |
|
| MolPort-046-158-520 |
0.74 |
Oc1ccc(\C=C\C(=O)OC\C=C\c2ccccc2)cc1 |
|
| MolPort-001-832-953 |
0.74 |
COC(=O)\C=C\c1ccc(OC)cc1 |
|
| MolPort-025-405-239 |
0.74 |
COc1ccc(C=CCO)cc1O |
|
| MolPort-000-881-745 |
0.74 |
OC(=O)\C=C\c1ccccc1 |
|
| MolPort-028-616-992 |
0.74 |
OC(=O)\C=C/c1ccccc1 |
|
| MolPort-002-886-915 |
0.74 |
OC\C=C\c1ccc(O)cc1 |
|
| MolPort-046-764-384 |
0.74 |
O[13C](=O)\[13CH]=[13CH]\c1ccccc1 |
|
| MolPort-003-935-545 |
0.74 |
[2H]\C(=C(\[2H])c1c([2H])c([2H])c([2H])c([2H])c1[2H])C(O)=O |
|
| MCULE-2307310731 |
0.74 |
[C@]1(C(=O)CO)(OC(=O)CCC)CC[C@@]2([H])[C@]3([H])CCC4=CC(=O)CC[C@]4(C)[C@@]3([H])[C@@H](O)C[C@]12C |
|
| MCULE-7949052065 |
0.73 |
C1([C@H]2[C@@]3(C(CC(C)(C)C3)C=1)C(=C)C(=O)OC2)C(O)=O |
|
| MCULE-1356077791 |
0.73 |
[C@H]12OC(=O)C([C@@H]1[C@@H](OC(/C(/C)=C/CO)=O)CC(=C)[C@]1([H])C=C[C@](O)(C)[C@@]12[H])=C |
|
| MCULE-4967241885 |
0.73 |
C1(C)C2C3C(=O)OC(=O)C3C(C2)C=1 |
|
| MCULE-3003712811 |
0.73 |
C(CC(C)CC)(OC1C(C(C)C)C(O)C=C(CO)C1=O)=O |
|
| MCULE-1423169810 |
0.73 |
C12C=C(C)C(=O)[C@@]1(O)[C@H](O)[C@]1(O[C@H]1[C@@]1([H])[C@]3([H])C(C)(C)[C@]3(OC(CCCCCCCCCCC)=O)C[C@@H](C)[C@@]12O)CO |
|
| MCULE-4960112087 |
0.73 |
[C@@]123C=C[C@@H](C(C(=O)O1)(C)[C@@]2([H])[C@@H]([C@@]12CC([C@@H](C1)[C@@H](O)C[C@]23[H])=C)C(O)=O)O |
|
| MCULE-2593667564 |
0.73 |
C1C=C(C(=O)C[C@@H]2[C@@H](C(C1)=C)C[C@]2(COC(=O)C)C)CO |
|
| MCULE-4804864002 |
0.73 |
[C@@]12(CC[C@@H](C[C@@]1(O)CC[C@@]1([H])[C@@]2([H])CC[C@]2([C@]1(O)CC[C@@H]2C1COC(=O)C=1)C)OC(CCC(O)=O)=O)COC(CCC(O)=O)=O |
|
| MCULE-7583261760 |
0.73 |
C12(C)CC(O)C3(C([H])(CCC4=CC(=O)CCC34C)C1([H])CCC2(O)C(=O)COC(CCC([O-])=O)=O)[H].[Na+] |
|
| MCULE-8663661247 |
0.73 |
C12C=C(C)C(O)CC3C(C)(C)C3C=C(C)C(=O)C1(OC(C)=O)CC(C)C2O |
|
| MCULE-9098558954 |
0.73 |
[C@H]1(O)C[C@]2(C)[C@@]3([H])CC[C@]4(C)[C@@]([H])([C@@](O)([C@@H]5OC(=O)[C@@H](C)[C@@]([H])([C@H](O)C)C5)C)CC[C@@]4(O)C3=CC(=O)[C@]2([H])C[C@H]1O |
|
| MCULE-3185796840 |
0.73 |
C12(C)CC(O)C3(C([H])(CCC4=CC(=O)CCC34C)C1([H])CCC2(O)C(=O)COC(C)=O)[H] |
|
| MCULE-8269410469 |
0.73 |
[C@]12(C)C[C@H](O)[C@]3([C@@]([H])(C[C@@H](C4=CC(=O)CC[C@]34C)C)[C@]1([H])CC[C@]2(O)C(=O)COC(C)=O)[H] |
|
| MCULE-7586213775 |
0.73 |
C12([H])CC(O)C3(C([H])(CCC4=CC(=O)CCC43[H])C1([H])CCC2(O)C(=O)COC(C)=O)[H] |
|
| MCULE-3344154059 |
0.73 |
O=C1CCC2(C3C(CC4(C)C(CCC4C3CCC2=C1)OC(C)=O)OC(C)=O)[H] |
|
| MCULE-5593960668 |
0.73 |
O=C1CCC2(C)C3C(O)CC4(C)C(CCC4C3CCC2=C1)OC(CC)=O |
|
| MCULE-7212307650 |
0.73 |
C1CC2CC1C1=C2C2CC1C1C(=O)OC(=O)C12 |
|
| MCULE-1124925533 |
0.73 |
C1(C)CC23CCCCCCCCCC2(C(=O)OC3=O)CC=1 |
|
| MCULE-5800803041 |
0.73 |
C1CCCC23C(=O)OC(=O)C2(CC=CC3)CCCCC1 |
|
| MCULE-8249868726 |
0.73 |
C1(=O)OC([C@@H]2[C@H]3C=C[C@H](O3)[C@@H]21)=O |
|
| MCULE-2875423098 |
0.73 |
C12(C)C[C@H](C3C4(C)C=CC(=O)CC4CCC3C1C[C@@H](C)[C@]2(O)C(=O)COC(=O)C)O |
|
| MCULE-9909269217 |
0.73 |
C1CC21C(C1C(=O)OC(=O)C1)C=CC2C |
|
| MCULE-3179520262 |
0.73 |
C1(=O)[C@H]2[C@@H]3C[C@@H](C=C3)[C@H]2C(=O)O1 |
|
| MCULE-7793896949 |
0.73 |
C12(CCC(CC1(O)CCC1([H])C2([H])CCC2(C1(O)CCC2C1COC(=O)C=1)C)OC(CCC(O)=O)=O)COC(CCC(O)=O)=O |
|
| MCULE-7155641625 |
0.73 |
C(=O)(OC1CC2CC1CC2)C1C(C(O)=O)C2CC1C=C2 |
|
| MCULE-9416510641 |
0.73 |
C1(=O)[C@H]2[C@H]3C[C@H](C=C3)[C@H]2C(=O)O1 |
|
| MCULE-7015396651 |
0.73 |
C12C(=O)OC(=O)C1C1CCCC2C=C1 |
|
| MCULE-9925372485 |
0.73 |
C12(C)CC(O)C3C(CCC4=CC(=O)CCC34C)C1CC[C@]2(OC(C)=O)C(=O)COC(C)=O |
|
| MCULE-5641241273 |
0.73 |
O=C1C2C3C=CC(CCCC3)C2C(=O)O1 |
|
| MCULE-8117200139 |
0.73 |
[C@]12([H])C(=O)OC(=O)[C@@]1([H])[C@]1([H])C[C@@]2([H])C(=C1)C |
|
| MCULE-7718531263 |
0.73 |
C1(=O)C2C3CC(C=C3)C2C(=O)O1 |
|
| MCULE-1884014689 |
0.73 |
O=C1OC[C@H](O)[C@@H](C[C@H]([C@](C)(O)[C@@H]2[C@]3(C)C(C4[C@@](CC3)([H])[C@]3(C)[C@](C[C@H]([C@H](C3)O)O)([H])C(=O)C=4)(O)CC2)O)[C@@H]1C |
|
| MCULE-4484538949 |
0.73 |
C1C[C@]2(C)C3[C@@H](O)C[C@]4(C)[C@@](O)(C(=O)COC(CCC)=O)CCC4C3CCC2=CC1=O |
|
| MCULE-5966997792 |
0.73 |
[C@]12(C)C[C@H](O)[C@]3([C@@]([H])(CCC4=CC(=O)CC[C@]34C)[C@]1([H])CC[C@]2(O)C(=O)COC(CC)=O)[H] |
|
| MCULE-5675720715 |
0.73 |
[C@@]12(CCC(CC1(O)CCC1C2CC[C@]2(C1(O)CCC2C1COC(=O)C=1)C)OC(CCC(O)=O)=O)COC(CCC(O)=O)=O |
|
| MCULE-5611461738 |
0.73 |
C1C[C@@]23[C@]([C@]([C@H]1O)(C)C(=O)O2)([H])[C@H](C(=O)O)[C@@]12CC(=C)[C@@]([H])(C1)CC[C@@]32[H].C1=C[C@]23OC(=O)[C@@](C)([C@@]2([H])[C@H](C(O)=O)[C@]24C[C@]([H])(C(=C)C2)CC[C@]43[H])[C@H]1O |
|
| MCULE-8359993163 |
0.73 |
C12(C)CC(O)C3C(CCC4=CC(=O)CCC34C)C1CCC2(OC(C)=O)C(=O)COC(C)=O |
|
| MCULE-8917764627 |
0.73 |
CC1C(=O)OC(C(O)(C2C3(C)CCC4C5(C)CC(O)C(O)CC5C(=O)C=C4C3(O)CC2)C)CC1C(O)C |
|
| MCULE-7276862551 |
0.73 |
[C@@]1(OC(=O)CCC)(C(=O)COC(=O)C)CC[C@@]2([H])[C@]3([H])C[C@@H](C4=CC(=O)CC[C@]4(C)[C@@]3([H])[C@@H](O)C[C@]12C)C |
|
| MCULE-7706016137 |
0.73 |
[Na+].[C@]12(C)C[C@@H]([C@]3([H])[C@@]4(C)CCC(=O)C=C4CC[C@@]3([H])[C@]1([H])CC[C@]2(O)C(=O)COC(=O)CCC([O-])=O)O |
|
| MCULE-4329306127 |
0.73 |
C[C@]12C[C@H](O)[C@]3([H])[C@]4(CCC(=O)C=C4CC[C@@]3([H])[C@]1([H])CC[C@]2(O)C(=O)COC(=O)CCC1CCCC1)C |
|
| MCULE-1716653767 |
0.73 |
CC(OCC([C@@]1([C@]2(C)[C@H]([C@H]3[C@H]([C@H](C2)O)[C@]2(C)C(=CC(CC2)=O)CC3)CC1)O)=O)=O |
|
| MCULE-8934792698 |
0.73 |
C1(=O)OC(C2C3C=CC(O3)C21)=O |
|
| MCULE-2860009537 |
0.73 |
C[C@@H]1C(=O)OC[C@H](O)[C@H]1C[C@H]([C@@]([C@@H]1[C@]2(C)[C@@](C3[C@@](CC2)([H])[C@]2(C)[C@](C[C@H]([C@H](C2)O)O)([H])C(=O)C=3)(O)CC1)(O)C)O |
|
| MCULE-6166946540 |
0.73 |
O=C1[C@H]2[C@@H]([C@H](CC[C@@]32OC3)C(C)C)C=C(C(=O)O)CO1 |
|
| MCULE-5307843642 |
0.73 |
C1[C@@]2(C)C(CC[C@]3([H])[C@]2([H])[C@H](O)C[C@@]2(C)[C@@]3([H])CC[C@]2(O)C(COC(=O)CCC)=O)=CC(=O)C1 |
|
| MCULE-5491138764 |
0.73 |
C1(=O)C2C(C)C=C(CC2C(=O)O1)C |
|
| MCULE-3525602825 |
0.73 |
CC(=O)OCC(=O)[C@@]1([C@]2(C[C@@H]([C@@H]3[C@]4(C)C(=CC(=O)CC4)CC[C@H]3[C@@H]2CC1)O)C)O |
|
| MCULE-9368478699 |
0.73 |
O=C1[C@]2([H])[C@]([C@@]3(C=C[C@@]2([H])C3)[H])(C)C(=O)O1 |
|
| MolPort-039-243-157 |
0.73 |
OC(=O)\C=C\c1ccc(c(O)c1)C(F)(F)F |
|
| MolPort-039-010-548 |
0.73 |
[K+].[O-]C(=O)C=Cc1ccccc1 |
|
| MolPort-038-946-131 |
0.73 |
CC(=O)\C=C\c1cccc(O)c1 |
|
| MolPort-039-241-483 |
0.73 |
OC(=O)C=Cc1ccc(c(O)c1)C(F)(F)F |
|
| MolPort-028-617-235 |
0.73 |
OC(=O)\C=C/c1ccc2ccccc2c1 |
|
| MolPort-027-639-013 |
0.73 |
CCOC(=O)C=Cc1cccc(OC)c1 |
|
| MolPort-027-838-689 |
0.73 |
COc1cc(C)c(\C=C\C(O)=O)c(C)c1 |
|
| MolPort-023-221-900 |
0.73 |
C1CNCCN1.COc1cc(\C=C\C(O)=O)ccc1O |
|
| MolPort-028-755-162 |
0.73 |
CCOC(=O)\C=C\c1cccc(OC)c1 |
|
| MolPort-001-769-171 |
0.73 |
OC(=O)\C=C\c1ccc2ccccc2c1 |
|
| MolPort-003-913-078 |
0.73 |
[K+].[O-]C(=O)\C=C\c1ccccc1 |
|
| MolPort-000-691-649 |
0.73 |
OC(=O)\C=C\c1cccc2ccccc12 |
|
| MolPort-009-654-280 |
0.73 |
OC(=O)C=Cc1cccc2ccccc12 |
|
| MolPort-001-785-894 |
0.73 |
COc1cc(\C=C\CO)ccc1O |
|
| MolPort-001-763-853 |
0.73 |
COc1cc(\C=C/CO)ccc1O |
|
| MolPort-028-617-235 |
0.73 |
OC(=O)\C=C/c1ccc2ccccc2c1 |
|
| MolPort-002-771-864 |
0.73 |
OC(=O)\C=C/c1cccc2ccccc12 |
|
| MolPort-003-913-203 |
0.73 |
[Na+].[O-]C(=O)\C=C\c1ccccc1 |
|
| MolPort-038-946-131 |
0.73 |
CC(=O)\C=C\c1cccc(O)c1 |
|
| MolPort-028-755-162 |
0.73 |
CCOC(=O)\C=C\c1cccc(OC)c1 |
|
| MolPort-027-639-013 |
0.73 |
CCOC(=O)C=Cc1cccc(OC)c1 |
|
| MolPort-027-838-689 |
0.73 |
COc1cc(C)c(\C=C\C(O)=O)c(C)c1 |
|
| MolPort-005-942-224 |
0.73 |
COc1ccc(O)c(\C=C\C(O)=O)c1 |
|
| MolPort-039-243-157 |
0.73 |
OC(=O)\C=C\c1ccc(c(O)c1)C(F)(F)F |
|
| MolPort-039-241-483 |
0.73 |
OC(=O)C=Cc1ccc(c(O)c1)C(F)(F)F |
|
| MolPort-023-221-900 |
0.73 |
C1CNCCN1.COc1cc(\C=C\C(O)=O)ccc1O |
|
| MolPort-001-740-843 |
0.73 |
Oc1ccc(\C=C\C(=O)OCc2ccccc2)cc1O |
|
| MolPort-039-010-548 |
0.73 |
[K+].[O-]C(=O)C=Cc1ccccc1 |
|
| MCULE-8234847813 |
0.72 |
[C@]12([H])C(=O)C=C3[C@]4([H])C[C@@](CC[C@@]4(CC[C@@]3(C)[C@]1(C)CC[C@@]1([H])C(C)(C)[C@H](CC[C@]21C)OC(=O)CCC([O-])=O)C)(C)C([O-])=O |
|
| MCULE-7604220648 |
0.72 |
O1C23C4(C5(C6(CCC15C=C2)C=CC4(CC3)O6)C(OC)=O)C(OC)=O |
|
| MCULE-3712584936 |
0.72 |
C12C(CC(=C(CCCOC(C)=O)C(C)C1O)C)OC(=O)C2=C |
|
| MCULE-4795427452 |
0.72 |
C(C1CC=C(C)C(=O)C1)(C)(C)OC(=O)C |
|
| MCULE-9723128082 |
0.72 |
C12CC(C=C1)CC2C(OC1(C)CCCC1)=O |
|
| MCULE-4012121864 |
0.72 |
[C@@H]1(CC=C(C)C(=O)C1)C(C)(C)OC(=O)C |
|
| MCULE-3197876959 |
0.72 |
CC1([C@@]2(OC(C(C)C)=O)[C@@H]1[C@H]1[C@@]([C@@H]([C@H]2OC(/C(=C/C)/C)=O)C)(O)[C@@H]2C=C(C(=O)[C@@]2(O)CC(CO)=C1)C)C |
|
| MCULE-7003052133 |
0.72 |
[C@]12(O)CC[C@@H]([C@@]1(C)CC[C@@]1([H])[C@@]2([H])CC[C@]2([C@]1(C=O)CC[C@H](OC(C)=O)C2)O)C1COC(=O)C=1 |
|
| MCULE-8457539977 |
0.72 |
C(C)(=O)OC1CCC2(C)C3C(CC4(C)C(CCC4C=3CCC2(C1)[H])OC(C)=O)=O |
|
| MCULE-2555920424 |
0.72 |
O=C(OC)[C@H]1[C@]2([H])C(=CC[C@]3([C@@]2([H])CC[C@]23CCC(=O)O2)C)[C@]2(C)C(=CC(=O)CC2)C1 |
|
| MCULE-1441261356 |
0.72 |
C12(O)CCC(C1(C)CCC1([H])C2([H])CCC2(C1(C=O)CCC(OC(C)=O)C2)O)C1COC(=O)C=1 |
|
| MCULE-7942598042 |
0.72 |
CC1[C@@H]2C[C@@H]3[C@@]4(C)[C@@]([C@H]([C@H]([C@@H]([C@@H]4[C@@]2(C)[C@H](O)C(=O)C=1)O)O)C)(O)[C@@H](O)C(=O)O3 |
|
| MCULE-8776636782 |
0.72 |
C1CC23C(=O)OC(=O)C2(CCCC3)CC=1 |
|
| MCULE-3891334939 |
0.72 |
C1C2CC3([H])C4CC5CCC(=O)C=5C4C([H])(C(=O)OC)C([H])(C(=O)OC)C3([H])C=2C(=O)C1 |
|
| MCULE-2794249583 |
0.72 |
C12(C)CC(O)C3C(CCC4=CC(=O)CCC34C)C1CCC2(O)C(=O)COC(=O)C=CC |
|
| MCULE-5454494701 |
0.72 |
C123CCC4C(C)(CCCC4(C)C(O)=O)C1CC(C1C(OC(=O)C21)=O)C(C(C)C)=C3 |
|
| MCULE-1087443932 |
0.72 |
C1CC2C3C(=O)OC(=O)C3C3CCCCC3=C2CC1 |
|
| MCULE-3334544373 |
0.72 |
C12=CCC3(C(CCC43CCC(=O)O4)C1C(CC1=CC(=O)CCC21C)C(OC)=O)C |
|
| MCULE-1753087854 |
0.72 |
C12C3C4CCCC4C1C(COC(C)=O)C1C4CCC5C(=O)C3C(C4=5)C21 |
|
| MCULE-1607221597 |
0.72 |
C12C3C(=O)OC(=O)C3C(C31CC3)C=C2 |
|
| MCULE-1795899971 |
0.72 |
C1CC23C(=O)OC(=O)C2(CCC3)CC=1 |
|
| MCULE-8868589151 |
0.72 |
C1(C)CC23CCCCC2(C(=O)OC3=O)CC=1 |
|
| MCULE-9103372368 |
0.72 |
C1(=O)C2C3CCC(C=C3)C2C(=O)O1 |
|
| MCULE-2122490766 |
0.72 |
C1CC23CCCCC2(C(=O)OC3=O)C2CCCCC=12 |
|
| MCULE-2769077006 |
0.72 |
C1CC23CC(C)(C)CC2(C(=O)OC3=O)CC=1 |
|
| MCULE-9544967893 |
0.72 |
O=C1C=CC2(COC(C)=O)C3C(CC4(C)C(CCC4(O)C3CCC2(O)C1)C(OCC)=O)OC(C)=O |
|
| MCULE-7462445595 |
0.72 |
C1(=O)[C@@H](O)[C@]2(C)[C@@]3([H])[C@@H](O)[C@H](O)[C@]4(OC[C@@]53[C@@]4(O)[C@@H](O)C(=O)O[C@]5([H])C[C@@]2([H])C(C)=C1)C |
|
| MCULE-5053755296 |
0.72 |
C1(C)CC23CCCCC2(C(=O)OC3=O)CC=1C |
|
| MCULE-2234048518 |
0.72 |
CC1([C@H](CC[C@@]2([C@]3(C(=O)C=C4[C@@](C)(CC[C@]5(C)[C@@]4([H])C[C@@](C)(C(=O)[O-])CC5)[C@]3(C)CC[C@@]12[H])[H])C)OC(=O)CCC(=O)[O-])C |
|
| MCULE-1981205050 |
0.72 |
CC1C2CC3OC(=O)C(O)C4(O)C53COC4(C)C(O)C(O)C5C2(C)C(O)C(=O)C=1 |
|
| MCULE-1278081687 |
0.72 |
[C@]12(C)C[C@@H]3C(=C)C(=O)O[C@@H]3C[C@H](C)C1=CC(=O)[C@@H]2O |
|
| MCULE-6232978473 |
0.72 |
C1(=O)O[C@H]2[C@@H]([C@@H](O)CC(C=O)=CCCC(CO)=C2)C1=C |
|
| MCULE-7395277343 |
0.72 |
C12(O)CC(CO)=CC3C4C(C)(C)C4(OC(=O)C(C)C)C(OC(=O)/C(=C/C)/C)C(C)C3(O)C1C=C(C)C2=O |
|
| MCULE-8617095272 |
0.72 |
C1(=O)O[C@H]2[C@@H]([C@H](O)CC(C=O)=CCCC(CO)=C2)C1=C |
|
| MCULE-1470831787 |
0.72 |
C1C[C@]2(C)C3C(=O)C=C4[C@]5([H])CC(C)(C)CC[C@]5(C(=O)O)CC[C@@]4(C)[C@]3(C)CCC2C(C)(C)[C@H]1OC(=O)C |
|
| MCULE-5714384003 |
0.72 |
C1(=O)[C@@H](O)[C@]2(C)C3[C@@H](O)[C@H](O)[C@H](C)[C@@]4(O)[C@]3(C)[C@H](OC(=O)[C@@H]4O)CC2C(C)=C1 |
|
| MCULE-7395356540 |
0.72 |
C1C[C@]2([H])[C@@](C)(C[C@H](O)C3=CC(=O)OC3)[C@H](C)C[C@H](O)[C@@]2(C)C(C(=O)OC)C1 |
|
| MCULE-8117348974 |
0.72 |
C/C(/C)=C/C1C(C)(C)C1C(OC1C(C)(C)C2C1CCO2)=O |
|
| MCULE-9485946749 |
0.72 |
C1(=O)C(O)C2(C)CC3OC(=O)C(=C)C3CC2C(C)=C1 |
|
| MCULE-3481914833 |
0.72 |
CC(=O)OCCCC1[C@@H](C)[C@@H](O)[C@@]2(C(C(=O)O[C@]2([H])CC=1C)=C)[H] |
|
| MolPort-046-069-423 |
0.72 |
Cc1cc(\C=C\C(O)=O)cc(c1O)C(C)(C)C |
|
| MCULE-2195755975 |
0.72 |
C12(O)CC(CO)=CC3C4C(C)(C)C4(OC(=O)C)C(OC(=O)/C(=C/C)/C)C(C)C3(O)C1C=C(C)C2=O |
|
| MolPort-001-792-047 |
0.72 |
OC(=O)C(=C\c1ccc(O)cc1)\C#N |
|
| MCULE-8780454429 |
0.72 |
[C@]12(O)CC(CO)=C[C@@]3([H])C4C(C)(C)[C@]4(OC(=O)C(C)CC)[C@H](OC(=O)/C(=C/C)/C)[C@@H](C)[C@]3(O)C1C=C(C)C2=O |
|
| MolPort-000-894-409 |
0.72 |
OC(=O)\C=C\c1ccc(O)c(Br)c1 |
|
| MCULE-9326656323 |
0.72 |
C12(O)CC(CC1(C)CCC1C2CCC2(C1(C=O)CCC(OC(C)=O)C2)O)C1COC(=O)C=1 |
|
| MolPort-008-647-360 |
0.72 |
COc1cccc(c1)C(\C)=C\C(O)=O |
|
| MCULE-4098552700 |
0.72 |
C1[C@@]2(C)C(C[C@@H](C(OC)=O)[C@]3([H])C2=CC[C@@]2(C)[C@@]3([H])CC[C@]32CCC(=O)O3)=CC(=O)C1 |
|
| MolPort-019-825-718 |
0.72 |
CC(C)COc1cccc(\C=C\C(O)=O)c1 |
|
| MCULE-3700642394 |
0.72 |
C12C(=O)C=C(CO)[C@]1([H])[C@H]1OC(=O)[C@H](C)[C@@H]1CCC=2C |
|
| MolPort-044-207-048 |
0.72 |
CCOc1ccc(C=CC(=O)OC)cc1OC |
|
| MCULE-9207728452 |
0.72 |
CC1(C2CCC3(C4(C)C(C5C(CC4)(C)CCC(C(=O)O)(C)C5)=CC(=O)C3C2(C)CCC1OC(CCC(=O)O)=O)C)C |
|
| MolPort-005-220-309 |
0.72 |
COc1cc(C=CC(O)=O)ccc1OCC=C |
|
| MCULE-3037222806 |
0.72 |
C1=C(C(=O)O)C[C@@H](OC(=O)/C(=C\C)/C)[C@H]2C(=C)C(=O)O[C@@H]2C=C(C)CC1 |
|
| MolPort-039-309-364 |
0.72 |
CCOC(=O)\C=C\c1cc(OC)c(O)c(OC)c1 |
|
| MCULE-3743818837 |
0.72 |
C1=C(CO)C(C(OC(=O)CC(C)C)C(C1O)C(C)C)=O |
|
| MolPort-000-157-638 |
0.72 |
COC(=O)\C=C\c1cc(OC)c(OC)c(OC)c1 |
|
| MCULE-2780089397 |
0.72 |
C1(C)(/C=C/C(CCC(O)=O)(O)C)C2CCC(=O)OC(C)(C)C2CC1 |
|
| MolPort-020-159-320 |
0.72 |
CCOC(=O)C=Cc1cc(OC)c(O)c(OC)c1 |
|
| MCULE-4960489764 |
0.72 |
C1[C@@H]([C@@]2([H])C(C=C[C@H](C)[C@@H]2CC[C@@H]2C[C@@H](O)CC(=O)O2)CC1)OC([C@@H](C)CC)=O |
|
| MolPort-000-490-741 |
0.72 |
COc1cc(\C=C\C(O)=O)ccc1OCC=C |
|
| MolPort-002-465-531 |
0.72 |
OC(=O)\C=C\c1ccc(OCC=C)cc1 |
|
| MolPort-023-197-972 |
0.72 |
OC(=O)C(=Cc1ccc(O)cc1)C#N |
|
| MolPort-000-931-485 |
0.72 |
OC(=O)\C=C\c1ccc(O)c(C=O)c1 |
|
| MolPort-003-867-542 |
0.72 |
COc1ccc(\C=C\C(O)=O)cc1C |
|
| MolPort-006-022-293 |
0.72 |
COc1cccc(c1)C(C)=CC(O)=O |
|
| MolPort-046-069-423 |
0.72 |
Cc1cc(\C=C\C(O)=O)cc(c1O)C(C)(C)C |
|
| MolPort-023-197-972 |
0.72 |
OC(=O)C(=Cc1ccc(O)cc1)C#N |
|
| MolPort-039-309-364 |
0.72 |
CCOC(=O)\C=C\c1cc(OC)c(O)c(OC)c1 |
|
| MolPort-020-159-320 |
0.72 |
CCOC(=O)C=Cc1cc(OC)c(O)c(OC)c1 |
|
| MolPort-044-207-048 |
0.72 |
CCOc1ccc(C=CC(=O)OC)cc1OC |
|
| MCULE-2313890542 |
0.71 |
[C@@H]1(O)[C@@H](O)[C@]2(C)[C@@]3([H])[C@@H](O)[C@H](O)[C@]4(OC[C@@]53[C@@]4(O)[C@@H](O)C(=O)O[C@]5([H])C[C@@]2([H])C(C)=C1)C |
|
| MCULE-1413309866 |
0.71 |
CC1CC2C(OC(=O)C2CC=1C)=O |
|
| MCULE-8652873501 |
0.71 |
C1C(CCCCC(CCC(=O)O)OC(=O)C)=C(C(C1)=O)CC=CCC |
|
| MCULE-2972497233 |
0.71 |
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-7361304189 |
0.71 |
[C@]123CC=C(C)[C@]1([H])[C@@H]1[C@@H](CC[C@@]2(O3)C)C(C(=O)O1)=C |
|
| MCULE-1400366705 |
0.71 |
[C@H]12C[C@H]1[C@H]1C=C[C@@H]2[C@@H]2C(=O)OC(=O)[C@@H]21 |
|
| MCULE-8746775494 |
0.71 |
[C@@H]12C3C(C)=CCC3[C@](C[C@H](OC(C)=O)C1C(C(=O)O2)=C)(C)O |
|
| MCULE-4992964291 |
0.71 |
C1C2C3CC(CC(=O)C)C3C(C3([H])C(=O)OC(=O)C32[H])C=1 |
|
| MCULE-9254356497 |
0.71 |
C12(C)C3C(C4(C)OC3(C)C=C4)C(C)(O1)C(C(=O)OC)=C2C(=O)OC |
|
| MCULE-9975535341 |
0.71 |
C1(=O)OC2C(CC=C(CCC(=O)C)C(C2)C)C1=C |
|
| MCULE-7995984986 |
0.71 |
CCCCC(CC)COC(C1CC=CCC1C(OCC(CC)CCCC)=O)=O |
|
| MolPort-000-490-788 |
0.71 |
COc1cc(\C=C\C(O)=O)ccc1OCC(C)C |
|
| MCULE-5187157844 |
0.71 |
C1(=O)O[C@H]2[C@@H]([C@H](CC3=CC(CC(C)=C2)OC3=O)OC(=O)C(C)=C)C1=C |
|
| MolPort-001-011-971 |
0.71 |
OC(=O)\C=C\c1ccc(\C=C\C(O)=O)cc1 |
|
| MCULE-5289910824 |
0.71 |
C12CC1C1C=CC2C2C(=O)OC(=O)C21 |
|
| MolPort-000-886-426 |
0.71 |
CCCOc1ccc(\C=C\C(O)=O)cc1OC |
|
| MCULE-9380832184 |
0.71 |
C12C(=O)OC(CC(=C[C@H]3OC(=O)C(=C)[C@@H]3[C@@H](OC(=O)/C(=C\C)/C)C1)C)C=2 |
|
| MolPort-000-886-529 |
0.71 |
CCOc1cc(\C=C\C(O)=O)ccc1OCCO |
|
| MCULE-3824820609 |
0.71 |
C1(C)CC2(C(=O)OC(=O)C2(C)CC=1)C |
|
| MolPort-001-785-893 |
0.71 |
COc1cc(\C=C(/C#N)C(O)=O)ccc1O |
|
| MCULE-4173076088 |
0.71 |
C12(C)C3C(C4OC3(C)C=C4)C(C)(O1)C(C(=O)OC)=C2C(=O)OC |
|
| MolPort-006-788-461 |
0.71 |
COc1cccc(\C=C/C(O)=O)c1OC |
|
| MCULE-4073913947 |
0.71 |
C12(C)C(C(C)=O)CCC1([H])C1(C([H])(C(OC(C)=O)C2)C2(C)CCC(C=C2CC1)=O)[H] |
|
| MolPort-000-492-408 |
0.71 |
COc1cccc(\C=C\C(O)=O)c1OC |
|
| MCULE-1889700737 |
0.71 |
[Na+].CC12CCC3([H])C(C(OC(=O)CCC([O-])=O)CCC3(C)C1([H])C(C=C1C3([H])CC(C)(C(O)=O)CCC3(C)CCC21C)=O)(C)C |
|
| MolPort-000-148-369 |
0.71 |
Cc1ccc(\C=C\C(O)=O)cc1 |
|
| MCULE-8772466243 |
0.71 |
C1CC23CCOC(=O)C2(CCCC3)CC=1 |
|
| MolPort-009-673-610 |
0.71 |
COc1cccc(C=CC(O)=O)c1OC |
|
| MCULE-5783941091 |
0.71 |
O=C(OCC1CC=CCC1)CCC1OCCC1 |
|
| MolPort-000-652-914 |
0.71 |
COc1cc(\C=C(\C#N)C(O)=O)ccc1O |
|
| MCULE-4340391803 |
0.71 |
CC1[C@H]2[C@H]3OC(=O)C(=C)[C@@H]3CC[C@]3(C)O[C@]23CC=1 |
|
| MolPort-044-226-097 |
0.71 |
COc1cc(C=C(C#N)C(O)=O)ccc1O |
|
| MCULE-3458261213 |
0.71 |
C12C3C(=O)OC(=O)C3C(C3C1C(=O)OC3=O)C=C2 |
|
| MolPort-000-480-277 |
0.71 |
COc1cc(\C=C\C(O)=O)ccc1OC(F)F |
|
| MCULE-1531690228 |
0.71 |
C1(COC(=O)C)C(C(=O)O)CC(C)=CC1 |
|
| MolPort-000-147-439 |
0.71 |
OC(=O)\C=C\c1ccc2OCOc2c1 |
|
| MCULE-7717916149 |
0.71 |
C12CC3=C(C)C(=O)OC3CC(O)(C)C1CCC2(C)O |
|
| MolPort-044-226-097 |
0.71 |
COc1cc(C=C(C#N)C(O)=O)ccc1O |
|
| MCULE-2566917767 |
0.71 |
C12C(O)C3CC(C)(C)CC3C(O)(C)CC=1C(=O)OC2 |
|
| MolPort-000-691-648 |
0.71 |
COc1ccc(C=C(C(O)=O)C(O)=O)cc1 |
|
| MCULE-5042813534 |
0.71 |
C12C(O)C3CC(CO)(C)CC3C(O)(C)CC=1C(=O)OC2 |
|
| MolPort-000-158-954 |
0.71 |
OC(=O)\C=C\c1cccc(OC(F)(F)F)c1 |
|
| MCULE-5537477153 |
0.71 |
C1CC(C(C)C)C(C2C1(O)COC2=O)/C=C(\CO)/C(=O)OCC1(O)C2C(=O)OCC(C(O)=O)=CC2C(C(C)C)CC1 |
|
| MolPort-000-150-785 |
0.71 |
CC(=O)Oc1ccc(\C=C\C(O)=O)cc1 |
|
| MCULE-1729468181 |
0.71 |
C1=CC2C3CC(=O)C3C1C1C(=O)OC(=O)C12 |
|
| MolPort-006-022-296 |
0.71 |
COc1ccc(cc1)C(C)=CC(O)=O |
|
| MCULE-9897298185 |
0.71 |
C12C(C(=O)OC1=O)C13CCCCC1=CC2C1C(=O)OC(=O)C31 |
|
| MolPort-003-736-075 |
0.71 |
COc1ccc(cc1)C(\C)=C\C(O)=O |
|
| MCULE-7609787636 |
0.71 |
O1C(=O)C2C(CC(=CC2)C)C1=O |
|
| MolPort-009-756-740 |
0.71 |
OC(=O)\C=C\c1ccc(O)c(F)c1 |
|
| MCULE-7406575942 |
0.71 |
C12(C)CC(=O)C3(C([H])(CCC4=CC(=O)CCC34C)C1([H])CCC2(O)C(=O)COC(C)=O)[H] |
|
| MolPort-001-760-449 |
0.71 |
CCCOc1ccc(\C=C\C(O)=O)cc1 |
|
| MCULE-3449742522 |
0.71 |
C1C(=O)C(C)=C[C@H]2OC(=O)C(=C)[C@@H]2[C@H](OC(=O)C(C)C)C[C@](O)(C)C=1 |
|
| MolPort-005-229-322 |
0.71 |
CCCOc1ccc(C=CC(O)=O)cc1 |
|
| MCULE-9709244279 |
0.71 |
C12C3C(C4OC3CC4)C(O1)C(C(=O)OC)=C2C(=O)OC |
|
| MolPort-001-768-521 |
0.71 |
CCOC(=O)\C=C\c1ccc(OC)cc1 |
|
| MCULE-9034458089 |
0.71 |
C12C3OC(C=C3)C1C1OC2C2C3OC(C(C(=O)OC)=C3C(=O)OC)C12 |
|
| MolPort-006-067-746 |
0.71 |
CC(C)COc1ccc(\C=C\C(O)=O)cc1 |
|
| MCULE-1609798784 |
0.71 |
C1[C@@H](C)OC(=O)C[C@H](O)[C@@H](O)C=C[C@H]1O |
|
| MolPort-000-886-361 |
0.71 |
CC(C)(C)c1cc(\C=C\C(O)=O)cc(c1O)C(C)(C)C |
|
| MCULE-2745275424 |
0.71 |
C123[C@@H]4[C@@H](CC[C@@]5(O[C@]1(C)[C@H]([C@@]([C@]1([H])C6C([C@@H]7[C@@H](CC[C@]6(C)O)[C@@H](C(=O)O7)C)=C(C)[C@]21[H])([H])C35)O)C)[C@@H](C(=O)O4)C |
|
| MolPort-003-909-874 |
0.71 |
CCOC(=O)C=Cc1ccc(OC)cc1 |
|
| MCULE-1226258144 |
0.71 |
C(OC)(C12C3CCC4(C)C(C5COC(C=5)=O)CC=C4C3CCC1(O)CC(O)CC2)=O |
|
| MolPort-004-288-330 |
0.71 |
OC(=O)C=Cc1ccc2OCOc2c1 |
|
| MCULE-5816353779 |
0.71 |
O1C(=O)C2C(CC(=CC2)CC/C=C(\C)/C)C1=O |
|
| MolPort-009-665-395 |
0.71 |
Cc1ccc(C=CC(O)=O)cc1 |
|
| MCULE-9672207738 |
0.71 |
O1[C@]2([H])[C@@]3([H])C(C)=CC[C@@]43O[C@]4(C)CC[C@@]2([H])C(=C)C1=O |
|
| MCULE-2969817322 |
0.71 |
C1=C2C(O[C@H]1CC(C)=C[C@H]1OC(=O)C(=C)[C@@H]1[C@@H](OC(=O)/C(=C\C)/C)C2)=O |
|
| MCULE-7767598477 |
0.71 |
[C@]12([H])C(C)=CC(=O)C1=C(C)C[C@H](OC(CCC=C)=O)[C@H]1[C@@H](C(=O)O[C@H]21)C |
|
| MCULE-5746673353 |
0.71 |
C1=CC2(O)CC(=O)OC2CC1=O |
|
| MCULE-2222797068 |
0.71 |
C1C[C@]2(C)[C@@]3([H])C[C@@H](OC(=O)/C=C(/C(C)C)\C)[C@]4(C)[C@](O)(C(C)=O)CC[C@]4(O)[C@]3(O)CC=C2C[C@H]1O |
|
| MCULE-5045023192 |
0.71 |
C[C@]12CC[C@@]3([H])C(C(=O)CC[C@]3(C)[C@]1([H])[C@@H](O)CC1=C([C@H](C)C[C@@H]([C@@]3([H])OC3(C)C)OC(=O)C)C(=O)C[C@]21C)(C)C |
|
| MCULE-8390750975 |
0.71 |
[C@]12(C)CC(=O)[C@]3([C@@]([H])(CCC4=CC(=O)CC[C@]34C)[C@]1([H])CC[C@]2(O)C(=O)COC(C)=O)[H] |
|
| MCULE-1234424378 |
0.71 |
C1=C2C(O[C@H]1CC(C)=C[C@H]1OC(=O)C(=C)[C@@H]1[C@@H](OC(=O)C(=C)C)C2)=O |
|
| MCULE-4461233711 |
0.71 |
[C@]12(C)CCC3C(CC[C@@]4([H])CC(CC[C@]34C)OC(CCC(O)=O)=O)C1CC=C2C(C)=O |
|
| MCULE-9408406006 |
0.71 |
[C@]123CC=C(C)[C@]1([H])[C@@H]1[C@@H](CC[C@@]2(O3)C)C(C(=O)O1)=C |
|
| MCULE-2320096475 |
0.71 |
C12C3C(C)=CCC3C(CC(OC(C)=O)C1C(C(=O)O2)=C)(C)O |
|
| MCULE-4559063392 |
0.71 |
C12C(=O)CC3(C)C(=CCC3C1CCC1CC(CCC21C)OC(=O)CC)C(=O)C |
|
| MCULE-4777670330 |
0.71 |
C123C4(C)CCC(=O)C=C4CC(C(OC)=O)C1C1CCC4(CCC(=O)O4)C1(CC2O3)C |
|
| MCULE-4112378800 |
0.71 |
[C@@]123CC=C(C)C1[C@@H]1[C@@H](CC[C@]2(O3)C)[C@@H](C(=O)O1)C |
|
| MCULE-3123508789 |
0.71 |
CC(O[C@H]([C@@H]1C(C)(C)O1)CC(C1=C2C[C@@H]([C@H]3[C@]4(CCC(C(C)(C)[C@@H]4CC[C@]3(C)[C@H]2CC1=O)=O)C)O)(C)C)=O |
|
| MCULE-3232378757 |
0.71 |
C12(C)C=C(C)C(C3C(OC(=O)C13)=O)C1C(OC(=O)C21)=O |
|
| MCULE-2804901759 |
0.71 |
C1=C2C(O[C@@H]1CC(C)=C[C@H]1OC(=O)C(=C)[C@@H]1[C@@H](OC(=O)C(=C)C)C2)=O |
|
| MCULE-4306149194 |
0.71 |
[C@@]123[C@@]4(C)CCC(=O)C=C4C[C@@H](C(OC)=O)[C@@]1([H])[C@]1([H])CC[C@]4(CCC(=O)O4)[C@]1(C[C@@]2([H])O3)C |
|
| MCULE-2724365529 |
0.71 |
[C@]12(C)[C@H](OC(=O)/C=C(\C)/C(C)C)C[C@]3([H])[C@@]4(C)CC[C@H](O)CC4=CC[C@@]3(O)[C@@]1(O)CC[C@]2(O)C(C)=O |
|
| MCULE-7135107425 |
0.71 |
[Na+].[Na+].[C@]12([H])C(=O)C=C3[C@]4([H])C[C@@](CC[C@@]4(CC[C@@]3(C)[C@]1(C)CC[C@@]1([H])C(C)(C)[C@H](CC[C@]21C)OC(=O)CCC([O-])=O)C)(C)C([O-])=O |
|
| MCULE-4273868412 |
0.71 |
C1C=C(C)CC(O)C2C(COC)C(=O)OC2C=C(C)C1 |
|
| MCULE-1085736388 |
0.71 |
C(OCC12C3CCC4(C)C(CCC4C3CC(C1(CC=CC2=O)[H])OC(C)=O)=O)(C)=O |
|
| MCULE-9975844805 |
0.71 |
O=C(OC1(C2CC3CC(C2)CC1C3)C)C1CC2CC1C=C2 |
|
| MCULE-9610038426 |
0.71 |
C1(COC(CCCC)=O)(COC(CCCC)=O)C(C)CC(=CC1C)C |
|
| MCULE-8638278493 |
0.71 |
O=C(OC1(CCCCC1)C)C1CC2CC1C=C2 |
|
| MCULE-1665605717 |
0.71 |
[Na+].[Na+].CC1([C@H](CC[C@@]2([C@]3(C(=O)C=C4[C@@](C)(CC[C@]5(C)[C@@]4([H])C[C@@](C)(C(=O)[O-])CC5)[C@]3(C)CC[C@@]12[H])[H])C)OC(=O)CCC(=O)[O-])C |
|
| MCULE-8275410960 |
0.71 |
O=C1CC[C@@]2([C@]3(C(=O)C[C@@]4(C)[C@](CC[C@@]4(C(=O)COC(=O)C)O)([H])[C@]3([H])CCC2=C1)[H])C |
|
| MCULE-7854744392 |
0.71 |
[C@@]123[C@@]4(C)CCC(=O)C=C4C[C@@H](C(OC)=O)[C@@]1([H])[C@]1([H])CC[C@]4(CCC(=O)O4)[C@]1(C[C@@]2([H])O3)C |
|
| MCULE-3397065732 |
0.71 |
[C@@]12(C)C(C(C)=O)CCC1C1C([C@H](OC(C)=O)C2)[C@@]2(C)CCC(C=C2CC1)=O |
|
| MCULE-2602485743 |
0.71 |
C123CC(C)CCC1=C(C(C1C(OC(=O)C21)=O)C1C(OC(=O)C31)=O)C |
|
| MCULE-7379430730 |
0.71 |
C1=C2C(O[C@@H]1CC(C)=C[C@H]1OC(=O)C(=C)[C@@H]1[C@@H](OC(=O)/C(=C\C)/C)C2)=O |
|
| MCULE-2319475587 |
0.71 |
C1C[C@]2(C)[C@@]34O[C@@H]3C[C@]3(C)[C@]5(CCC(=O)O5)CC[C@@]3([H])[C@]4([H])[C@H](C(OC)=O)CC2=CC1=O |
|
| MCULE-6016945740 |
0.71 |
C(C)(=O)OC1CCC2(C)C(O)(C1)C(C=C1C3CCC(C(C)C=CC(C)C(C)C)C3(C)CCC21)=O |
|
| MCULE-5393900833 |
0.71 |
C(C)(=O)OC1CCC2(C)C3(C4C(OC(C4C4(C5CCC(C(C)C=CC(C)C(C)C)C5(C)CCC42[H])C=C3)=O)=O)C1 |
|
| MCULE-7378412710 |
0.71 |
C12(C)CC(O)C3C(CCC4=CC(=O)CCC34C)C1CCC2C(=O)CC(OCCC(O)=O)=O |
|
| MolPort-046-684-176 |
0.70 |
CCOC(=O)\C=C\c1ccc(OC)c2ccccc12 |
|
| MolPort-020-358-087 |
0.70 |
COCCOc1cccc(\C=C\C(O)=O)c1 |
|
| MolPort-003-741-940 |
0.70 |
CC\C(=C/c1cccc(OC)c1)C(O)=O |
|
| MolPort-004-288-300 |
0.70 |
COc1ccc(OC)c(C=CC(O)=O)c1 |
|
| MolPort-044-207-140 |
0.70 |
COC(=O)C=Cc1ccc2cc(OC)ccc2c1 |
|
| MolPort-020-358-087 |
0.70 |
COCCOc1cccc(\C=C\C(O)=O)c1 |
|
| MolPort-000-679-610 |
0.70 |
COc1cc(\C=C\C(O)=O)ccc1OC(C)=O |
|
| MolPort-035-864-414 |
0.70 |
OC(=O)\C=C\c1ccc(O)cc1F |
|
| MolPort-044-387-184 |
0.70 |
OC(=O)C=Cc1ccc(OC(F)F)cc1 |
|
| MolPort-028-748-876 |
0.70 |
COc1cc(C=CC(O)=O)ccc1OC(C)=O |
|
| MolPort-044-207-140 |
0.70 |
COC(=O)C=Cc1ccc2cc(OC)ccc2c1 |
|
| MolPort-023-278-383 |
0.70 |
COc1cc(\C=C\C(O)=O)ccc1Br |
|
| MolPort-005-264-303 |
0.70 |
COCCOc1cccc(C=CC(O)=O)c1 |
|
| MolPort-000-652-916 |
0.70 |
COc1ccc(OC)c(\C=C\C(O)=O)c1 |
|
| MolPort-000-148-423 |
0.70 |
Cc1cccc(\C=C\C(O)=O)c1 |
|
| MolPort-044-387-184 |
0.70 |
OC(=O)C=Cc1ccc(OC(F)F)cc1 |
|
| MolPort-000-146-418 |
0.70 |
OC(=O)\C=C\c1ccc(OC(F)(F)F)cc1 |
|
| MolPort-023-278-383 |
0.70 |
COc1cc(\C=C\C(O)=O)ccc1Br |
|
| MolPort-002-464-692 |
0.70 |
CCOc1cc(\C=C\C(O)=O)ccc1OCC(C)C |
|
| MolPort-000-490-604 |
0.70 |
COc1cc(\C=C\C(O)=O)ccc1OCC#N |
|
| MolPort-019-872-288 |
0.70 |
CCOC(=O)\C=C\c1ccc(OCC)c(OC)c1 |
|
| MolPort-000-492-034 |
0.70 |
CCCOc1ccc(\C=C\C(O)=O)cc1OCC |
|
| MolPort-000-162-807 |
0.70 |
OC(=O)\C=C/c1ccc(OC(F)F)cc1 |
|
| MolPort-002-916-132 |
0.70 |
COc1cc(C=C(C(O)=O)C(O)=O)cc(OC)c1OC |
|
| MolPort-028-748-876 |
0.70 |
COc1cc(C=CC(O)=O)ccc1OC(C)=O |
|
| MolPort-009-677-284 |
0.70 |
OC(=O)C=Cc1ccc(OC(F)(F)F)cc1 |
|
| MolPort-006-826-085 |
0.70 |
Cc1cc(C)cc(\C=C\C(O)=O)c1 |
|
| MolPort-000-004-109 |
0.70 |
COc1ccc(\C=C\C(O)=O)c(O)c1 |
|
| MolPort-035-864-414 |
0.70 |
OC(=O)\C=C\c1ccc(O)cc1F |
|
| MolPort-005-945-922 |
0.70 |
COc1ccc(\C=C\CO)cc1OC |
|
| MolPort-000-514-588 |
0.70 |
C\C(=C/c1ccccc1)C(O)=O |
|
| MolPort-046-684-176 |
0.70 |
CCOC(=O)\C=C\c1ccc(OC)c2ccccc12 |
|
| MolPort-000-222-871 |
0.70 |
OC(=O)\C=C\c1ccc(OC(F)F)cc1 |
|
| MCULE-5385404753 |
0.70 |
C1C=C(C)CCC2C(COC)C(=O)OC2C=C(C)C1 |
|
| MCULE-4385148400 |
0.70 |
OCC1=CC(C2=C(C)CC[C@H]3C(=C)C(=O)O[C@@H]3[C@]21[H])=O |
|
| MCULE-4351037464 |
0.70 |
C1(=O)[C@@](O)(C)C[C@@H]([C@@H]2[C@H](OC(=O)C2=C)C=C(C)C(O)C1)OC(=O)C(C)=C |
|
| MCULE-4900002928 |
0.70 |
C1=CC2(C)C3[C@@H](OC(C)=O)CC4(C)[C@](C(=O)COC(C)=O)(O)CCC4C3C[C@H](C)C2=CC1=O |
|
| MCULE-1739744430 |
0.70 |
[C@]12(C)CC[C@]3([C@@]([H])(CCC4=CC(=O)CC[C@]34C)[C@]1([H])CC[C@]12CCC(=O)O1)[H] |
|
| MCULE-1159348886 |
0.70 |
C1=C(C)C[C@H](O)[C@H]2C(=C)C(=O)O[C@@H]2C=C(C)CC1 |
|
| MCULE-8016431488 |
0.70 |
C1C[C@]2(C)[C@@]3([H])CC=C4[C@]5([H])C[C@@]6(C(=O)O[C@@]([H])(C6)[C@]5(C)CC[C@@]4(C)[C@]3(C)CC[C@@]2([H])C(C)(C)[C@H]1O)C |
|
| MCULE-8149583555 |
0.70 |
C1(C)C(O)CC=C(C)C(O)CC(=O)OC(C)C(C)CCC=1 |
|
| MCULE-4899690160 |
0.70 |
C[C@]12CC[C@]3([H])[C@]4(CCC(=O)C=C4[C@@H]4C[C@@H]4[C@@]3([H])[C@]1([H])[C@@H]1C[C@@H]1[C@]12CCC(=O)O1)C |
|
| MCULE-3991113418 |
0.70 |
O1C(CCC)C(O)C(O)C=CCCC(O)C1=O |
|
| MCULE-9035451811 |
0.70 |
C12(C)CCC3(C([H])(CCC4=CC(=O)CCC34C)C1([H])CCC12CCC(=O)O1)[H] |
|
| MCULE-6607478643 |
0.70 |
C1(=O)[C@@H](O)[C@]2(C)C3[C@H](O)[C@H](O)[C@H](C)C4C(O[C@@H]([C@]34C)[C@H](O)C2C(C)=C1)=O |
|
| MCULE-2600806760 |
0.70 |
C1CC2C3(O)CCC(C)(C=C)C=C3C(=O)OC(=O)C=2C(C)(C)C1 |
|
| MCULE-5595198949 |
0.70 |
[C@@]12(CC[C@@H](C[C@@]1(O)CC[C@]1([H])[C@]2([H])CC[C@]2([C@]1(O)CC[C@@H]2C1COC(=O)C=1)C)O)C(OC)=O |
|
| MCULE-8693881242 |
0.70 |
C12(C3(C4[C@@]5([H])OC(=O)C(=C)C5CC[C@@](O)(C4(C1)C=C3)C)C)C(O[C@@]1([H])C2C[C@@H](OC(=O)C)[C@](O)(C)C2C1C(C)=CC2)=O |
|
| MCULE-2935787590 |
0.70 |
O=C1C=CC2(C)C(C1)(CCC1C3CCC(C(C)CCC(C)C(C)C)C3(C)CC(C21)OC(C)=O)[H] |
|
| MCULE-1089229934 |
0.70 |
C/C=C(/C(O[C@H]1[C@H]2C(C(O[C@@H]2C=C(C)[C@@H](O)C[C@H]2O[C@]2(C)C1)=O)=C)=O)\C |
|
| MCULE-7903674091 |
0.70 |
CC(COC1C(C)(C)C(OC(C2CC=CCC2)=O)C1)C |
|
| MCULE-6074025811 |
0.70 |
C12(C)CC(OC(C)=O)C3C(CCC4=CC(=O)C=CC34C)C1CC[C@]2(O)C(=O)COC(C)=O |
|
| MCULE-4613990318 |
0.70 |
O=C1CCC2(C)C3C(CC4(C)C(O)(CCC4C3CCC2=C1)C(COC(C)=O)([H])OC(C)=O)=O |
|
| MCULE-6412555386 |
0.70 |
[C@@]12(C)CC[C@@]3(C)[C@@]4([H])OC(=O)[C@@](C4)(C)C[C@@]3([H])C1=CC[C@]1([H])[C@@]3(C)CC[C@H](O)C(C)(C)[C@]3([H])CC[C@@]21C |
|
| MCULE-7846274654 |
0.70 |
[C@]12(C)CC[C@]3([C@@]([H])(CCC4=CC(=O)CC[C@]34C)[C@]1([H])CC[C@]2(O)C(=O)COC(CCC(O)=O)=O)[H] |
|
| MCULE-6317272202 |
0.70 |
C(C)(=O)OC1CCC2(C)C3CCC4(C)C(=CCC4C3CCC2(C1)[H])C(OC)=O |
|
| MCULE-2122796304 |
0.70 |
C(O)(C12CCC(O)CC1(O)CCC1C3=CCC(C3(C)CCC21)C(OCC)=O)=O |
|
| MCULE-4387351983 |
0.70 |
[C@]12(C)C[C@H](OC(C)=O)[C@]3([C@@]([H])(CCC4=CC(=O)C=C[C@]34C)[C@]1([H])CC[C@]2(O)C(=O)COC(C)=O)[H] |
|
| MCULE-9683452020 |
0.70 |
C12C3C(C)=CC(C4C3C3C4C(OC3=O)=O)C1C(OC2=O)=O |
|
| MCULE-8329941805 |
0.70 |
[C@]12(C)C[C@H](OC(C)=O)[C@]3([C@@]([H])(CCC4=CC(=O)C=C[C@]34C)[C@]1([H])C[C@@H](C)[C@]2(O)C(=O)COC(C)=O)[H] |
|
| MCULE-3732438270 |
0.70 |
C(O)(C12C3CCC4(C)C(C5COC(C=5)=O)CC=C4C3CCC1(O)CC(O)CC2)=O |
|
| MCULE-3280168913 |
0.70 |
C1C(C(CCC=1C)CC(OCC)=O)O |
|
| MCULE-5702185362 |
0.69 |
[C@]123O[C@@]1([H])[C@@]1([H])[C@@](O1)(C(C)C)[C@@H](O)[C@]12O[C@@]1([H])C[C@@]1([H])C2COC(=O)C=2CC[C@]31C |
|
| MCULE-4251451769 |
0.69 |
C1C(OC(C)=O)C2(C)C(C=O)=C(C)CCC2OC1C(O)(C)C |
|
| MCULE-5581720234 |
0.69 |
C12CCC(=O)C=1C1C3C4C5C(C(OC)=O)(C1(C(OC)=O)C4C1C(=O)CCC5=1)C23 |
|
| MCULE-2143241951 |
0.69 |
C12C(=O)CCC=1C1C3C4C5C(C(OC)=O)(C1(C(OC)=O)C4C1C(=O)CCC5=1)C23 |
|
| MCULE-6061453971 |
0.69 |
C1C[C@]2([C@]3([H])[C@@H](OC(=O)C)C[C@@]4(O)C(C([C@@]3(C4)[C@H](O)C[C@]2([H])[C@@](COC(=O)C)(C)C1)=O)=C)C |
|
| MCULE-9660798204 |
0.69 |
C1(=O)CCC(O)C(C1)(C/C=C(\C)/CC/C=C(\C)/C(=O)OC)CC(=O)OC |
|
| MCULE-3581898493 |
0.69 |
C1C[C@]2(C)[C@]34O[C@H]3[C@@H]3O[C@]3(C(C)C)[C@@H](O)[C@]34O[C@H]3C[C@@]2([H])C2COC(=O)C1=2 |
|
| MCULE-6092837871 |
0.69 |
[C@@]12([H])OC(=O)[C@@H]([C@@]1([H])CC=C(CCO)[C@@H](C)C2)C |
|
| MCULE-5501928946 |
0.69 |
C1(=O)CC2(C/C=C(\C)/CC(=O)/C=C(\C)/C)CC(=O)OC2CC1 |
|
| MCULE-7433867323 |
0.69 |
C1(=O)CC2(CC(=O)OC2CC1)C/C=C(\C)/CC/C=C(\C)/C |
|
| MCULE-3183629646 |
0.69 |
O=C1CC2(C)C(C3COC(C=3)=O)CCC2(O)C2CCC3CC(O)CCC3(C)C21 |
|
| MCULE-6120787334 |
0.69 |
C12CC34CCCCC3(C=C1)C4C(=O)O2 |
|
| MCULE-6905450558 |
0.69 |
O1C(=O)CC(CC=CCCCCCC)C1=O |
|
| MCULE-8928562205 |
0.69 |
C(C)(=O)OC1CC(O)C2(CO)C3C(CC4(C)C(C5COC(C=5)=O)CCC4(O)C3CCC2(O)C1)OC(C)=O |
|
| MCULE-9355176433 |
0.69 |
[C@]12([H])C(C)=CC(=O)C1=C(C)C[C@H](OC(CCCC)=O)[C@H]1[C@@H](C(=O)O[C@H]21)C |
|
| MCULE-1490809166 |
0.69 |
[C@]12([H])C(C)=CC(=O)C1=C(C)C[C@H](OC(CC)=O)[C@H]1[C@@H](C(=O)O[C@H]21)C |
|
| MCULE-8546366669 |
0.69 |
[C@]12(C)C[C@H](OC(C)=O)[C@]3([C@@]([H])(CCC4=CC(=O)C=C[C@]34C)[C@]1([H])CC[C@]2(OC(C)=O)C(=O)COC(C)=O)[H] |
|
| MCULE-8983467960 |
0.69 |
C1(C(=O)OC2CC(C(CC=C)=C2C)=O)C(C1(C)C)C(C)=CC |
|
| MCULE-1835141621 |
0.69 |
C12C3C=CC(C3=C(C)C)C1C(OC2=O)=O |
|
| MCULE-1090478714 |
0.69 |
[C@]12([H])C(C)=CC(=O)C1=C(C)C[C@H](OC(CC(C)C)=O)[C@H]1[C@@H](C(=O)O[C@H]21)C |
|
| MCULE-7290707084 |
0.69 |
[C@]12([H])C(C)=CC(=O)C1=C(C)C[C@H](OC(CCC)=O)[C@H]1[C@@H](C(=O)O[C@H]21)C |
|
| MCULE-8267556474 |
0.69 |
C12C3C(C)(CCC(C)(C3)C(=O)OC3CCCCC3C)CCC1(C)C1(C(C(=O)C=2)C2(C)CCC(C(C)(C)C2CC1)OC(C)=O)C |
|
| MCULE-4774974878 |
0.69 |
[C@]12([H])C(C)=CC(=O)C1=C(C)C[C@H](OC(CCCCC)=O)[C@H]1[C@@H](C(=O)O[C@H]21)C |
|
| MCULE-9509535864 |
0.69 |
[C@]12(C)CCC3C(CC[C@@]4([H])CC(CC[C@]34C)OC(CCC)=O)C1CC=C2C(C)=O |
|
| MCULE-6914138383 |
0.69 |
[C@]12(C)CCC3[C@@]([H])(CC[C@@]4([H])C[C@@H](CC[C@]34C)OC(CCC(C)C)=O)C1CC=C2C(C)=O |
|
| MCULE-7666040130 |
0.69 |
[C@]12(C)CCC3C(CC[C@@]4([H])CC(CC[C@]34C)OC(CCCCCCCCC)=O)C1CC=C2C(C)=O |
|
| MCULE-6880830630 |
0.69 |
[C@]12(C)CC[C@]3([C@@]([H])(CCC4=CC(=O)CC[C@]34C)[C@]1([H])CC[C@]2(OC(C)=O)C(=O)COC(CCC(O)=O)=O)[H] |
|
| MCULE-5035790043 |
0.69 |
[C@]12(C)C=CC(C=C1[C@H](C[C@@]1([H])[C@]3([C@@](C)([C@@](CC3)(OC(C)=O)C(=O)COC(C)=O)C[C@H](OC(C)=O)[C@]21[H])[H])C)=O |
|
| MCULE-4633674199 |
0.69 |
C12C(C)=CC(=O)C1=C(C)C[C@H](OC(C)=O)C1[C@@H](C(=O)O[C@H]21)C |
|
| MCULE-9823859068 |
0.69 |
C12C(C)=CC(=O)C1=C(C)CC(O)C1C(C(=O)OC21)C |
|
| MCULE-8304268118 |
0.69 |
[C@]12(C)CCC(C=C1CCC1C2CC[C@]2(C1CCC2OC(CCC(O)=O)=O)C)=O |
|
| MCULE-9194849346 |
0.69 |
C1C=CC(C)C2C(=O)OC(=O)C12 |
|
| MCULE-9689647613 |
0.69 |
[C@]12([H])C(C)=CC(=O)C1=C(C)C[C@H](O)[C@@]1([H])[C@H](C(=O)O[C@H]21)C |
|
| MCULE-6243457309 |
0.69 |
C12(C)CC(OC(C)=O)C3C(CCC4=CC(=O)C=CC34C)C1CCC2(OC(C)=O)C(=O)COC(C)=O |
|
| MCULE-8267103874 |
0.69 |
C12C(C)=CC(=O)C1=C(C)C[C@H](O)C1[C@@H](C(=O)O[C@H]21)C |
|
| MolPort-035-395-334 |
0.69 |
OC(=O)C=Cc1ccc2OCCOc2c1 |
|
| MolPort-006-395-716 |
0.69 |
Oc1cc(O)cc(\C=C/c2ccc(O)c(O)c2)c1 |
|
| MolPort-046-793-316 |
0.69 |
[2H]c1c([2H])c(\C=C\c2cc(O)cc(O)c2)c([2H])c(O)c1O |
|
| MolPort-044-193-515 |
0.69 |
Oc1cc(O)cc(C=Cc2ccc(O)c(O)c2)c1 |
|
| MolPort-028-744-768 |
0.69 |
Oc1cc(\C=C\c2cc(O)c(O)c(O)c2)cc(O)c1O |
|
| MolPort-044-800-811 |
0.69 |
COc1cc(\C=C\C(O)=O)ccc1N |
|
| MolPort-044-206-593 |
0.69 |
COC(=O)C(=Cc1cccc(O)c1)C#N |
|
| MolPort-028-956-928 |
0.69 |
COCOc1ccc(\C=C\C(O)=O)cc1 |
|
| MolPort-039-240-366 |
0.69 |
OC(=O)C=Cc1cc(F)c(O)c(F)c1 |
|
| MolPort-046-682-512 |
0.69 |
OC(=O)\C=C\c1cc(F)c(O)c(F)c1 |
|
| MolPort-022-572-438 |
0.69 |
CCOc1ccc(\C=C\C(O)=O)cc1C |
|
| MolPort-022-378-549 |
0.69 |
COC\C=C\c1ccc(O)c(OC)c1 |
|
| MolPort-046-203-967 |
0.69 |
Oc1ccc(\C=C\c2cccc(O)c2)cc1 |
|
| MolPort-035-394-986 |
0.69 |
Oc1ccc(C=CC(=O)OCCc2ccccc2)cc1O |
|
| MolPort-035-395-308 |
0.69 |
COc1cc(C=CC(O)=O)cc(Cl)c1O |
|
| MolPort-028-744-768 |
0.69 |
Oc1cc(\C=C\c2cc(O)c(O)c(O)c2)cc(O)c1O |
|
| MolPort-046-793-316 |
0.69 |
[2H]c1c([2H])c(\C=C\c2cc(O)cc(O)c2)c([2H])c(O)c1O |
|
| MolPort-000-720-545 |
0.69 |
COc1ccc(\C=C\C(O)=O)c(OC)c1OC |
|
| MolPort-001-741-244 |
0.69 |
COc1cc(\C=C\C=O)cc(OC)c1O |
|
| MolPort-046-203-967 |
0.69 |
Oc1ccc(\C=C\c2cccc(O)c2)cc1 |
|
| MolPort-002-131-415 |
0.69 |
CC(=O)\C=C\c1ccc(O)cc1 |
|
| MolPort-035-395-334 |
0.69 |
OC(=O)C=Cc1ccc2OCCOc2c1 |
|
| MolPort-035-395-308 |
0.69 |
COc1cc(C=CC(O)=O)cc(Cl)c1O |
|
| MolPort-003-665-504 |
0.69 |
Oc1ccc(\C=C\C(=O)OCCc2ccccc2)cc1O |
|
| MolPort-035-394-986 |
0.69 |
Oc1ccc(C=CC(=O)OCCc2ccccc2)cc1O |
|
| MolPort-000-679-605 |
0.69 |
OC(=O)\C=C\c1ccc2OCCOc2c1 |
|
| MolPort-000-490-752 |
0.69 |
COc1cc(\C=C\C(O)=O)cc(Cl)c1O |
|
| MolPort-001-023-006 |
0.69 |
COc1ccc(\C=C(/C#N)C(O)=O)cc1OC |
|
| MolPort-000-893-740 |
0.69 |
COc1cc(\C=C\C(O)=O)ccc1OCC#C |
|
| MolPort-002-464-588 |
0.69 |
CCOc1cc(\C=C\C(O)=O)ccc1OCCOc1ccccc1 |
|
| MolPort-002-046-133 |
0.69 |
COc1ccc(\C=C(/S)C(O)=O)cc1OC |
|
| MCULE-4026127058 |
0.69 |
C(C)(=O)OC1CCC2(C)C(C1)(CC(C1C3CCC(C(C)C=CC(C)C(C)C)C3(C)CCC2=1)=O)[H] |
|
| MolPort-016-541-695 |
0.69 |
COCCOc1cc(\C=C\C(O)=O)ccc1OC |
|
| MCULE-6377189094 |
0.69 |
C(C)(=O)OC1CC(O)C2(COC(C)=O)C3C(CC4(C)C(C5COC(C=5)=O)CCC4(O)C3CCC2(O)C1)OC(C)=O |
|
| MolPort-022-378-549 |
0.69 |
COC\C=C\c1ccc(O)c(OC)c1 |
|
| MCULE-1836906318 |
0.69 |
[C@]12(C)CCC3C(CC[C@@]4([H])CC(CC[C@]34C)OC(CCCCC)=O)C1CC=C2C(C)=O |
|
| MolPort-046-682-512 |
0.69 |
OC(=O)\C=C\c1cc(F)c(O)c(F)c1 |
|
| MCULE-6478036230 |
0.69 |
C1CC2(COC(=O)C2([H])CC=1)C |
|
| MolPort-002-143-928 |
0.69 |
OC(=O)\C=C\c1cccc(\C=C\C(O)=O)c1 |
|
| MCULE-1252077735 |
0.69 |
C1CC23CC(=O)OC(=O)C2(CCCC3)CC=1 |
|
| MolPort-044-193-515 |
0.69 |
Oc1cc(O)cc(C=Cc2ccc(O)c(O)c2)c1 |
|
| MCULE-8726454334 |
0.69 |
[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 |
|
| MolPort-001-740-425 |
0.69 |
Oc1cc(O)cc(\C=C\c2ccc(O)c(O)c2)c1 |
|
| MCULE-1566350070 |
0.69 |
C1=C(C)C[C@@H](O)[C@H]2C(=C)C(=O)O[C@@H]2C=C(C)C[C@@H]1O |
|
| MolPort-044-206-593 |
0.69 |
COC(=O)C(=Cc1cccc(O)c1)C#N |
|
| MCULE-3556341827 |
0.69 |
CC(C12C(O)C34C(CC5C(C)(C63C(O6)C1O2)CCC1C(OCC5=1)=O)O4)C |
|
| MolPort-022-572-438 |
0.69 |
CCOc1ccc(\C=C\C(O)=O)cc1C |
|
| MCULE-2716253173 |
0.69 |
C(C)(=O)OC1C=CCC2C(OC(C21)=O)=O |
|
| MolPort-044-800-811 |
0.69 |
COc1cc(\C=C\C(O)=O)ccc1N |
|
| MCULE-5015030206 |
0.69 |
CCCCCCCCCCCCCCCCCCOC([C@]1(CC[C@@]2(C)[C@](C3=CC([C@]4([C@](CC[C@@]5([C@@]4(CC[C@](O)(C5(C)C)[H])C)[H])(C)[C@]3(C)CC2)[H])=O)(C1)[H])C)=O |
|
| MolPort-000-671-986 |
0.69 |
COC(=O)C(=C\c1cccc(O)c1)\C#N |
|
| MCULE-5787926051 |
0.69 |
C1CC2COC(C=2C(C1C(C)C)/C=C(\CO)/C(=O)O)=O |
|
| MolPort-002-469-069 |
0.69 |
OC(=O)\C=C\c1ccc(OCC#N)cc1 |
|
| MCULE-1868424196 |
0.69 |
O=C1CCC2(C)C3C(CC4(C)C(CCC4C3CC(C2=C1)OC(C)=O)C(C)=O)OC(C)=O |
|
| MolPort-028-956-928 |
0.69 |
COCOc1ccc(\C=C\C(O)=O)cc1 |
|
| MCULE-2188882812 |
0.69 |
C1C([H])(C)C2([H])C(=O)OC(=O)C2([H])C([H])(C)C=1 |
|
| MolPort-004-788-985 |
0.69 |
CCOc1ccc(\C=C\C=O)cc1OC |
|
| MCULE-9101975825 |
0.69 |
C1CC2(C)C3C(=O)CC4(C)C(C5(C)CCC(=O)O5)CC(O)C4(C)C=3C(=O)CC2C(C)(C)C1=O |
|
| MolPort-000-002-661 |
0.69 |
OC(=O)\C=C\c1ccc(O)cc1Cl |
|
| MCULE-4124934247 |
0.69 |
[C@@]12([H])[C@@H](OC(=O)[C@H]1CO)C=C(CO)[C@@]2([H])CO |
|
| MolPort-039-240-366 |
0.69 |
OC(=O)C=Cc1cc(F)c(O)c(F)c1 |
|
| MCULE-9182352754 |
0.69 |
C1C2OC2C=CC(C(C)(C)C(=O)OC1CC(CCC)O)O |
|
| MCULE-5859688598 |
0.69 |
C(C)(=O)OC1CCC2(C)C3C(CC4(C)C(=CCC4C3CCC2(C1)[H])C(C)=O)=O |
|
| MCULE-1158025792 |
0.69 |
O=C1CC(CC=CCCCCCCCCCCCCCCC)C(=O)O1 |
|
| MCULE-8227756693 |
0.69 |
C1(=O)C2C(C)C(C)=CC(/C=C(/C)\C)C2C(=O)O1 |
|
| MCULE-3941924250 |
0.69 |
C1(C(OCC)=O)CC1C=CC(O)=O |
|
| MCULE-8771172896 |
0.69 |
C1CC2(C)C3C(=O)OCC=3CC(O)C2C(C)(C)C1OC(=O)/C(/C)=C\C |
|
| MCULE-3538974417 |
0.69 |
C(OC)(C12C3C=CC(C1(C1C=CC2O1)C(OC)=O)O3)=O |
|
| MCULE-9188129386 |
0.69 |
[C@]12([H])C(C)=CC(=O)C1=C(C)C[C@H](OC(C)=O)[C@H]1[C@@H](C(=O)O[C@H]21)C |
|
| MCULE-5243784193 |
0.69 |
C(OCCCCCCCCCCCCCCCCCC)(=O)[C@@]1(C[C@@]2(C3=CC([C@]4([H])[C@]5(C)C(CC[C@]4([C@@]3(CC[C@]2(CC1)C)C)C)C(C)(C)[C@H](CC5)O)=O)[H])C |
|
| MCULE-9464302631 |
0.69 |
C12C(O)[C@@]([H])(CCC([C@]3([C@](CC1)([C@](C)(C(OC)=O)CCC3)[H])C)=O)C(=O)C=2 |
|
| MCULE-4185314226 |
0.69 |
C12C(C)=CC(=O)C1=C(C)CC(OC(C)=O)C1C(C(=O)OC21)C |
|
| MCULE-4236608409 |
0.69 |
C(O[C@]12C(C)(C)[C@@]1([H])[C@@]1([H])C(=O)[C@]3(C=C(C)[C@H](O)[C@@]3(O)[C@H](O)C(CO)=C1)[C@H](C)C2)(=O)CCCCCCCCCCC |
|
| MolPort-006-826-180 |
0.68 |
COc1cc(\C=C\C(O)=O)ccc1F |
|
| MolPort-022-574-740 |
0.68 |
CC(C)Oc1ccc(\C=C\C(O)=O)cc1C |
|
| MolPort-003-800-273 |
0.68 |
OC(=O)C(=C/c1ccc(O)cc1)\c1ccccc1 |
|
| MolPort-001-770-833 |
0.68 |
COc1ccccc1\C=C/C(O)=O |
|
| MolPort-000-860-922 |
0.68 |
COc1ccccc1\C=C\C(O)=O |
|
| MolPort-004-288-328 |
0.68 |
COc1ccccc1C=CC(O)=O |
|
| MolPort-003-932-008 |
0.68 |
COc1cc(\C=C\CO)cc(OC)c1O |
|
| MolPort-000-141-704 |
0.68 |
COc1cc(\C=C\C(O)=O)cc(Br)c1O |
|
| MolPort-039-063-519 |
0.68 |
CCCCCCCCCCCCCCCCCCOC(=O)\C=C\c1ccc(O)c(O)c1 |
|
| MolPort-003-355-235 |
0.68 |
COc1ccc(\C=C\C(O)=O)cc1OCC#C |
|
| MolPort-023-298-972 |
0.68 |
CCCCCCCCCCCCCCCCCCCCCCOC(=O)\C=C\c1ccc(O)c(O)c1 |
|
| MolPort-011-018-575 |
0.68 |
COc1cc(C=CC(O)=O)cc(Br)c1O |
|
| MolPort-003-741-925 |
0.68 |
C\C(=C/c1ccc2OCOc2c1)C(O)=O |
|
| MolPort-006-120-673 |
0.68 |
CC(=O)Oc1ccc(\C=C\C(O)=O)cc1OC(C)=O |
|
| MolPort-009-532-430 |
0.68 |
COC(=O)C=Cc1ccc(OCCO)c(OC)c1 |
|
| MolPort-000-886-394 |
0.68 |
COc1ccc(Br)c(\C=C\C(O)=O)c1 |
|
| MolPort-022-385-109 |
0.68 |
COC(=O)\C=C\c1ccc(O)c(Cl)c1 |
|
| MolPort-006-112-904 |
0.68 |
COc1cc(C=CC(C)=O)ccc1O |
|
| MolPort-001-823-649 |
0.68 |
COc1cc(\C=C\C(C)=O)ccc1O |
|
| MCULE-2906301243 |
0.68 |
[C@]12(C)CC[C@]3([C@@]([H])(CCC4=CC(=O)CC[C@]34C)[C@]1([H])CC[C@]2(O)C(=O)COC(CCCC)=O)[H] |
|
| MCULE-2014291882 |
0.68 |
C(OCC)(C1CC=C2C1(C)CCC1C2CCC2(O)CC(O)CCC21CO)=O |
|
| MCULE-4895972010 |
0.68 |
C12(O)CCC(C1(C)CCC1C2([H])CCC2(C1(C=O)CCC(O)C2)O)C1COC(=O)C=1 |
|
| MCULE-4800012179 |
0.68 |
O=C1CCC2(COC(C)=O)C3C(CC4(C)C(CCC4(O)C3CCC2=C1)C(OCC)=O)OC(C)=O |
|
| MCULE-5086433803 |
0.68 |
CC1[C@@H]2CC([C@@]3([C@@H]([C@@]2(C)[C@H](O)C(=O)C=1)[C@@H](O)[C@H]1OC(=O)[C@@H]3[C@H]1C)C)=O |
|
| MCULE-8064344923 |
0.68 |
[C@]12(C)C[C@H](OC(C)=O)[C@]3([C@@]([H])(CCC4=CC(=O)C=C[C@]34C)[C@]1([H])C[C@@H](C)[C@]2(O)C(CO)=O)[H] |
|
| MCULE-3419267005 |
0.68 |
[C@]12(C)C[C@H](O)[C@]3([C@@]([H])(CCC4=CC(=O)CC[C@]34C)[C@]1([H])CC[C@]2(O)C(=O)COC(CN)=O)[H] |
|
| MCULE-9074787128 |
0.68 |
[C@]12([H])C(=O)C=C3[C@]4([H])[C@@H](C)[C@@H](CC[C@@]4(CC[C@@]3(C)[C@]1(C)CC[C@@]1([H])[C@@](C)(C(=O)O)[C@@H](CC[C@]21C)OC(=O)C)C)C |
|
| MCULE-7571794100 |
0.68 |
O=C(O)C12C3CCC4(C)C(C5COC(C=5)=O)CCC4(O)C3CCC1(O)CC(O)CC2 |
|
| MCULE-9685471149 |
0.68 |
C12(C)CCC3C(CCC4=CC(=O)CCC34C)C1CC[C@]2(O)C(=O)COC(CCCCCCCCCCCCCCCCC)=O |
|
| MCULE-9979696719 |
0.68 |
CC1C(C)C2C(C)(CCC3(C)C4(C)CCC5C(C(O)=O)(C)C(OC(C)=O)CCC5(C)C4C(=O)C=C32)CC1 |
|
| MCULE-6263626972 |
0.68 |
C1(=O)[C@@H](O)[C@]2(C)C3[C@@H](O)[C@@H]4OC(=O)[C@@H]([C@H]4C)[C@]3(C)C(=O)C[C@@]2([H])C(C)=C1 |
|
| MCULE-2255903955 |
0.68 |
O1C([C@@H](C)[C@@H]2CC[C@]3(C=CC(C(C)=C3[C@@H]12)=O)C)=O |
|
| MCULE-5657172823 |
0.68 |
O(C(CCCC)=O)[C@]1(C(COC(C)=O)=O)CC[C@H]2[C@@H]3CCC4=CC(C=C[C@]4(C)[C@H]3[C@H](C[C@@]21C)O)=O |
|
| MCULE-9485008266 |
0.68 |
[C@]12(O)CC[C@H](C3COC(=O)C=3)[C@@]1(C)[C@@H](CC1[C@@]3([C@]([H])(C[C@H](CC3)OC(C)=O)CC[C@]12[H])C)OC(C)=O |
|
| MCULE-9894416903 |
0.68 |
C1CC2(C)C3(CCC(C=C)(C)C=C3C(O)=O)OC(=O)C2C(C)(C)C1 |
|
| MCULE-3718325887 |
0.68 |
O(C(CC)=O)[C@]1(C(COC(C)=O)=O)CC[C@H]2[C@@H]3C[C@H](C)C4=CC(C=C[C@]4(C)[C@H]3[C@H](C[C@@]21C)O)=O |
|
| MCULE-5385888311 |
0.68 |
CC1OC(CC2(C(O)=O)CC=CC2)CC1 |
|
| MCULE-3017671740 |
0.68 |
C(C)(=O)OC1CC(C2(COC(C)=O)C3C(CC4(C)C(C5COC(C=5)=O)CCC4(O)C3CCC2(O)C1)OC(C)=O)OC(C)=O |
|
| MCULE-8118520301 |
0.68 |
C1[C@]2(C)[C@@]3([H])CC[C@@]4(C)[C@@]([H])(CC[C@]4(OC(=O)CC)C(=O)CO)[C@]3([H])CCC2=CC(=O)C1 |
|
| MCULE-2381125258 |
0.68 |
C1(=O)[C@@H](O)[C@]2(C)C3C4(OC[C@@]53[C@@](O)([C@@H](O)C(=O)O[C@@H]5CC2C(C)=C1)C(=C)[C@H]4O)O |
|
| MCULE-2383807113 |
0.68 |
C1[C@@H](C)OC(=O)C[C@@H](O)C=C[C@H]2O[C@@H]12 |
|
| MCULE-8822838184 |
0.68 |
C1C[C@]2(C)C3[C@@H](OC(=O)C)C[C@]4(C)[C@@H](C(=O)COC(=O)C)CCC4C3CCC2=CC1=O |
|
| MCULE-2852293806 |
0.68 |
C12(C)C=CC(=O)OC(C)(C)C1CC(OC(C)=O)C1(C)C3C(=O)OC(C)C(=O)C3(C)C(=C)CC12 |
|
| MCULE-6504048226 |
0.68 |
C1C=C(C)CC(OC(=O)C)C2C(=C)C(=O)OC2C=C(C)C1 |
|
| MCULE-9006451734 |
0.68 |
[C@]12(C)CCC3C(CCC4=CC(=O)CC[C@]34C)C1CC[C@]2(O)C(=O)COC(C)=O |
|
| MCULE-9611860953 |
0.68 |
C(O)(=O)[C@]12[C@@](C3=CC[C@]4([H])[C@]5(C)C(CC[C@]4([C@@]3(CC1)C)C)C(C)(C)[C@@H](OC(=O)[C@]13[C@@](C4=CCC6[C@]7(C)C(CC[C@]6([C@@]4(CC1)C)C)C(C)(C)C(=O)CC7)([H])[C@@H](C)[C@H](C)CC3)CC5)([H])[C@@H](C)[C@H](C)CC2 |
|
| MCULE-9352251517 |
0.68 |
[C@]12(C)CC[C@]3([C@@]([H])(CCC4=CC(=O)CC[C@]34C)[C@]1([H])CC[C@]2(OC(C)=O)C(CO)=O)[H] |
|
| MCULE-7361055399 |
0.68 |
CC12C3C(O)CC4(C)C5(OC(=O)CC5)CCC4C3C=CC1=CC(=O)CC2 |
|
| MCULE-8569314397 |
0.68 |
O=C(C(=CCO)C)O[C@H]1[C@]2(C(C(=O)O[C@]2([H])C=C(C)[C@@H](OC(=O)C)CC=C(COC(=O)C)C1)=C)[H] |
|
| MCULE-4523943869 |
0.68 |
C1C=C(C)CC(OC(=O)C)C2C(COC)C(=O)OC2C=C(C)C1 |
|
| MCULE-7602245034 |
0.68 |
C12C3C4C5C6C3(C(OC)=O)C3(C(=O)OC(CC1)C2C34)C5C1CC=CC61 |
|
| MCULE-7226741017 |
0.68 |
C12(C3C=CC(C45C=CC34CC=CC5)C1([H])C(=O)OC2=O)[H] |
|
| MCULE-2276317128 |
0.68 |
C12C3C(C)(CCC(C)(C(OCC=C)=O)C3)CCC1(C)C1(C(C(=O)C=2)C2(C)CCC(C(C)(C)C2CC1)OC(C)=O)C |
|
| MCULE-3565112538 |
0.68 |
C1(C(OCC)=O)(C(OCC)=O)CC(C)=C(CC1C(O)=O)C |
|
| MCULE-3362275267 |
0.68 |
C1CC=CC2C(C(OCC)=O)C2CC1 |
|
| MCULE-7515529172 |
0.68 |
C12C(C)(CCC3C(C(=O)OC13)C)C=CC(=O)C=2C |
|
| MCULE-3223183548 |
0.68 |
C12[C@@](C)(CCC3[C@@H](C(=O)O[C@H]13)C)C=CC(=O)C=2C |
|
| MCULE-1257766731 |
0.68 |
O=C1O[C@@]2([H])[C@]34[C@]([C@]5([C@H](O)C(=O)C=C(C)[C@@]5(C2)[H])C)([H])[C@@]([C@@H](C(=C)[C@]3(O)[C@H]1O)O)(O)OC4 |
|
| MCULE-6690425983 |
0.68 |
C1=CC2C3C(C)=C(C)C3C1C1C(=O)OC(=O)C12 |
|
| MCULE-2603538836 |
0.68 |
C12C(C(=O)OC1=O)C1C=CC2C23CCCCC12C=C3 |
|
| MCULE-3146262991 |
0.68 |
C1=CC2C3C=C(C)C3C1C1C(=O)OC(=O)C12 |
|
| MCULE-6074226479 |
0.68 |
C1=CC2C3C4CCCCC=4C3C1C1C(=O)OC(=O)C12 |
|
| MCULE-7580027619 |
0.68 |
C12C(C=C1)C1C(=O)OC(=O)C21 |
|
| MCULE-6660850303 |
0.68 |
[C@]12(O)CC[C@H]([C@@]1(C)CC[C@@]1([H])[C@@]2([H])CC[C@]2([C@]1(C=O)CC[C@H](O)C2)O)C1COC(=O)C=1 |
|
| MCULE-6568122363 |
0.68 |
[C@]12(C)C=CC(C=C1[C@H](C[C@@]1([H])[C@]3([C@@](C)([C@@](CC3)(OC(CC)=O)C(=O)COC(C)=O)C[C@H](O)[C@]21[H])[H])C)=O |
|
| MCULE-4463064740 |
0.68 |
C(OCC)(C1CC2CC1C=C2)=O |
|
| MCULE-1939387046 |
0.68 |
[C@]12(C)CC[C@]3([C@@]([H])(CCC4=CC(=O)CC[C@]34C)[C@]1([H])CC[C@]2(O)C(=O)COC(CCCCCCCCCCCCCCCCC)=O)[H] |
|
| MCULE-4172470592 |
0.68 |
C(C)(=O)OC1CCC2(C)C(C1)(C(C=C1C3CCC(C(C)C=CC(C)C(C)C)C3(C)CCC12[H])=O)[H] |
|
| MCULE-4168657248 |
0.68 |
[C@H]1(CCC(=O)CCCCCCC)[C@H](O)C[C@H](O)[C@@H]1C/C=C\CCCC(=O)OC(C)C |
|
| MCULE-3976819674 |
0.68 |
[C@]12(C)CC[C@]3([C@@]([H])(CCC4=CC(=O)CC[C@]34C)[C@]1([H])CC[C@]2(O)C(=O)COC(=O)C(C)(C)C)[H] |
|
| MCULE-7783529046 |
0.68 |
C12(C)CCC3C(CCC4=CC(=O)CCC34C)C1CCC2(O)C(=O)COC(C)=O |
|
| MCULE-1090723140 |
0.68 |
[C@]12(C)CC[C@]3([C@@]([H])(CCC4=CC(=O)CC[C@]34C)[C@]1([H])CC[C@]2(O)C(=O)COC(CC)=O)[H] |
|
| MCULE-3239458544 |
0.68 |
[C@@]123[C@]([H])(C[C@@]4([H])C5COC(=O)C=5CC[C@]4(C)[C@]41O[C@]4([C@@]1(O[C@]1(C(C)C)[C@H]2OC(CCC(O)=O)=O)[H])[H])O3 |
|
| MCULE-2766753223 |
0.68 |
C(=O)(OC(C)C)C1CC2CC1C=C2 |
|
| MCULE-3754202975 |
0.68 |
C12C3C(C)(CCC(C)(C(O)=O)C3)CCC1(C)C1(C(C(=O)C=2)C2(C)CCC(C(C)(C)C2CC1)OC(C)=O)C |
|
| MCULE-6868177435 |
0.68 |
C1(=O)[C@@H](O)[C@]2(C)[C@@]3([H])C4(O)OC[C@@]53[C@@](O)([C@@H](O)C(=O)O[C@]5([H])C[C@@]2([H])C(C)=C1)C(=C)[C@H]4O |
|
| MCULE-2488392484 |
0.68 |
[C@]12(C)CC[C@]3([C@@]([H])(CC[C@@]4([H])C[C@H](CC[C@]34C)OC(C)=O)[C@]1([H])CC(C)=C2C(C)=O)[H] |
|
| MCULE-6305611152 |
0.68 |
C12C3(C(O)=O)C(C(=O)O)(C4OC3C=C4)C(O1)C=C2 |
|
| MCULE-2339507429 |
0.68 |
C12(C)CCC3C(CCC4=CC(=O)CCC34C)C1CCC2(OC(C)=O)C(CO)=O |
|
| MCULE-7209202316 |
0.68 |
C12(C)CC(O)C3C(CCC4=CC(=O)C=CC34C)C1CCC2(O)C(=O)COC(CCC(O)=O)=O |
|
| MCULE-8643661135 |
0.68 |
O=C1C2C3C4C=CC4C(C=C3)C2C(=O)O1 |
|
| MCULE-6747628390 |
0.68 |
[C@]12(O)CC[C@@H]([C@@]1(C)CCC1[C@@]2([H])CC[C@]2([C@]1(C=O)CC[C@H](O)C2)O)C1COC(=O)C=1 |
|
| MCULE-7618445658 |
0.68 |
C1C=C(C)C[C@H]([C@H]2C(=C)C(O[C@@H]2C=C(C)[C@H]1OC(=O)C)=O)OC(=O)/C(/CO)=C/CO |
|
| MCULE-8133468470 |
0.68 |
C1CC2(C)C3COC(=O)C=3C(OC)C(O)C2C(C)(C)C1 |
|
| MCULE-9803186551 |
0.68 |
[C@]12(C)CC[C@]3([C@@]([H])(CCC4=CC(=O)CC[C@]34C)[C@]1([H])CC[C@]2(O)C(=O)COC(C)=O)[H] |
|
| MCULE-4630794584 |
0.68 |
C12(C=O)CC[C@H](CC1(O)CC[C@@]1([H])CC3(C(C)(CC(C3)C3COC(=O)C=3)C[C@]21[H])O)O |
|
| MCULE-6591915280 |
0.68 |
[C@H]12OC(=O)C(=C)[C@H]1[C@H](OC(=O)CC(C)CC)C([C@@H](C)CCCO)=C(C)C2 |
|
| MCULE-1326219832 |
0.68 |
C(CCCOC(=O)C)(C)C1C(OC(=O)CC(C)CC)C2C(=C)C(=O)OC2CC=1C |
|
| MCULE-8945561023 |
0.68 |
C1=C[C@]2(C)[C@@]3([H])[C@@H](O)C[C@]4(C)[C@](C(=O)COC(=O)CCC(=O)O)(O)CC[C@@]4([H])[C@]3([H])C[C@H](C)C2=CC1=O |
|
| MCULE-8432569167 |
0.68 |
C1(O)C=C(C)CC(OC(=O)/C(/CO)=C/C)C2C(=C)C(=O)OC2C=C(C)C1 |
|
| MCULE-9998977190 |
0.68 |
[C@H]12OC(=O)C(=C)[C@H]1[C@H](OC(=O)C(C)C)C([C@@H](C)CCCO)=C(C)C2 |
|
| MCULE-1031631524 |
0.68 |
[C@H]12OC(=O)C(=C)[C@H]1[C@H](OC(=O)C(C)C)C([C@@H](C)CCCOC(=O)C)=C(C)C2 |
|
| MCULE-8109250856 |
0.68 |
[C@]12(C)C[C@@H]([C@]3([H])[C@@]4(C)C=CC(=O)C=C4CC[C@@]3([H])[C@]1([H])CC[C@]2(O)C(=O)COC(=O)CCC(=O)O)O |
|
| MCULE-5533130729 |
0.68 |
C1C[C@@]2(C3C(=O)C=C4[C@@]5([H])[C@](CC[C@@]4(C)[C@@]3(CCC2[C@]([C@@H]1OC(C)=O)(C(=O)O)C)C)(C)CC[C@@H](C)[C@@H]5C)C |
|
| MCULE-9037199231 |
0.68 |
OC(C1(CC=CC1)CC1OCCC1)=O |
|
| MCULE-7541323970 |
0.68 |
C1C(=O)OC(CCCCCC(C(=O)C)C)C=1 |
|
| MCULE-6686022329 |
0.68 |
C1(CCCCCCC(=O)OC)=C[C@@H](O)CC1=O |
|
| MCULE-9072555005 |
0.68 |
C1(O)C=C(C)CC(OC(=O)/C(/CO)=C\C)C2C(=C)C(=O)OC2C=C(C)C1 |
|
| MCULE-3709898565 |
0.68 |
C1C=C(C)CC(OC(=O)/C(/C)=C/CO)C2C(=C)C(=O)OC2C=C(CO)C1 |
|
| MCULE-4784866063 |
0.68 |
CCC(=O)O[C@]1([C@]2(C)[C@@]([C@]3([C@@](CC2)([H])[C@]2(C)C(=CC(=O)CC2)CC3)[H])([H])CC1)C(=O)CO |
|
| MCULE-5527954946 |
0.68 |
O=C(/C(=C/CO)/C)O[C@H]1[C@]2(C(C(=O)O[C@]2([H])C=C(C)[C@@H](OC(=O)C)CC=C(COC(=O)C)C1)=C)[H] |
|
| MCULE-2943378861 |
0.68 |
[C@]12([H])C(C)=CC(=O)C1=C(C)C[C@H](OC(C1CCCCC1)=O)[C@H]1[C@@H](C(=O)O[C@H]21)C |
|
| MCULE-1338496475 |
0.68 |
C1=C(C)C[C@@H](OC(=O)C)[C@H]2C(=C)C(=O)O[C@@H]2C=C(C)CC1 |
|
| MCULE-6020138869 |
0.68 |
C1C2CC(CC2C(=O)OC(C)(C)C)C=1 |
|
| MCULE-6499205732 |
0.68 |
O=C1C=C(CCC2OCCCC2)CC1 |
|
| MCULE-5708210639 |
0.68 |
C1C23COC(C2)C(C(O)=O)(O)CCC3C(C(O)(C)C)=C1 |
|
| MCULE-2303945332 |
0.68 |
C1(=O)[C@@H](O)[C@]2(C)[C@@]3([H])C4(O)OC[C@@]53[C@@]([H])(CC(=O)O[C@]5([H])C[C@@]2([H])C(C)=C1)C(=C)[C@H]4O |
|
| MCULE-2962714006 |
0.68 |
[C@@]12(CC[C@@H](C[C@@]1(O)CC[C@]1([H])[C@]2([H])CC[C@]2([C@]1(O)CC[C@@H]2C1COC(=O)C=1)C)O)C(O)=O |
|
| MCULE-3982920419 |
0.68 |
[C@@]123CC[C@H]([C@@]1(O)CCC(C(=O)O)=CC2)[C@@](C)(/C=C/C=C(\C)/C(=O)O)OC3=O |
|
| MCULE-6377062249 |
0.68 |
OC(C=CC(C1C2OC(CC2)C1)=O)=O |
|
| MCULE-3305666834 |
0.68 |
[C@H]12OC(=O)C([C@@H]1[C@H](OC(/C(/C)=C/CO)=O)C[C@]1(O)CO[C@@H]3C=C(C)[C@@]2([H])[C@]13[H])=C |
|
| MCULE-2930807712 |
0.68 |
C1[C@H](OC(=O)C)C(C)=C[C@@]2([H])OC(=O)C([C@]2([H])[C@H](OC(/C(/C)=C/CO)=O)CC(COC(=O)C)=C1)=C |
|
| MCULE-6800370955 |
0.68 |
C1C[C@]2(C)[C@@]3([H])C(=O)C=C4[C@]5([H])[C@@H](C)[C@H](C)CC[C@]5(C)CC[C@@]4(C)[C@]3(C)CC[C@@]2([H])[C@@](C)(C(=O)O)[C@@H]1OC(=O)C |
|
| MCULE-1950814728 |
0.68 |
C1[C@@H](O)C2[C@@H](C)[C@@]3([H])OC(=O)C(=C)[C@@]3([H])CC2=C(C)C1 |
|
| MCULE-8110589241 |
0.68 |
C12CC1C1C=CC2C(C1C(=O)OC(C)C)C(O)=O |
|
| MCULE-4569544045 |
0.68 |
C12(O)CCC(C1(C)CC[C@]1([H])C(CCC(O)CC(=O)CC[C@@]21[H])=O)C1COC(=O)C=1 |
|
| MCULE-6665058711 |
0.68 |
C12(C)CC(O)C3C(CCC4=CC(=O)C=CC34C)C1CC[C@]2(O)C(=O)COC(CCC(O)=O)=O |
|
| MCULE-3190191335 |
0.68 |
C1(=O)C=C2[C@](C)(C=C1)[C@]1([H])[C@]([H])([C@@]3([H])[C@@](C[C@@H]1O)(C)[C@@](O)(C(=O)COC(=O)CCC(O)=O)CC3)CC2 |
|
| MCULE-6981908624 |
0.68 |
C12(C)C=CC(C=C1C(CC1([H])C3(C(C)(C(CC3)(OC(CC)=O)C(=O)COC(C)=O)CC(O)C21[H])[H])C)=O |
|
| MCULE-8222265685 |
0.68 |
C1(CC23CC(OC2CCC1(O)C3)=O)/C(/C)=C\C(=O)/C=C(\C)/C |
|
| MCULE-4974199679 |
0.68 |
C12[C@@](C)(CC[C@H]3[C@@H](C(=O)O[C@H]13)C)C=CC(=O)C=2C |
|
| MCULE-5483330032 |
0.68 |
O[C@@H]1[C@H]2[C@@H](C[C@H](C)C3[C@]2(C)C=CC(=O)C=3)[C@H]2[C@@](C)([C@](C(=O)COC(=O)CCC(O)=O)(O)CC2)C1 |
|
| MolPort-022-385-109 |
0.68 |
COC(=O)\C=C\c1ccc(O)c(Cl)c1 |
|
| MolPort-023-298-972 |
0.68 |
CCCCCCCCCCCCCCCCCCCCCCOC(=O)\C=C\c1ccc(O)c(O)c1 |
|
| MolPort-027-721-452 |
0.68 |
OC(=O)C\C(=C/c1cccc(O)c1)C(O)=O |
|
| MolPort-039-063-519 |
0.68 |
CCCCCCCCCCCCCCCCCCOC(=O)\C=C\c1ccc(O)c(O)c1 |
|
| MolPort-022-574-740 |
0.68 |
CC(C)Oc1ccc(\C=C\C(O)=O)cc1C |
|
| MolPort-044-204-385 |
0.68 |
COc1cccc(C=C(C#N)C(O)=O)c1 |
|
| MolPort-000-492-592 |
0.68 |
COC(=O)\C=C\c1ccc2OCOc2c1 |
|
| MolPort-001-787-544 |
0.68 |
COc1ccc(\C=C\C=O)cc1 |
|
| MolPort-000-886-325 |
0.68 |
COc1cc(\C=C\C(O)=O)cc(I)c1O |
|
| MolPort-044-204-385 |
0.68 |
COc1cccc(C=C(C#N)C(O)=O)c1 |
|
| MolPort-000-902-344 |
0.68 |
COc1cccc(\C=C(/C#N)C(O)=O)c1 |
|
| MolPort-027-721-452 |
0.68 |
OC(=O)C\C(=C/c1cccc(O)c1)C(O)=O |
|
| MolPort-019-640-936 |
0.67 |
COC(=O)C=Cc1ccccc1 |
|
| MolPort-001-783-139 |
0.67 |
COC(=O)\C=C\c1ccccc1 |
|
| MolPort-001-766-836 |
0.67 |
C\C(=C/C(O)=O)c1ccccc1 |
|
| MolPort-002-464-591 |
0.67 |
CCOc1ccc(OCCOc2ccc(\C=C\C(O)=O)cc2OCC)cc1 |
|
| MolPort-006-022-351 |
0.67 |
CC(=CC(O)=O)c1ccccc1 |
|
| MolPort-020-108-592 |
0.67 |
COc1cc(C=C(C(O)=O)c2ccccc2)ccc1O |
|
| MolPort-000-148-364 |
0.67 |
Cc1ccccc1\C=C\C(O)=O |
|
| MolPort-003-665-680 |
0.67 |
COc1cc(\C=C\C=O)cc(OC)c1OC |
|
| MolPort-000-492-046 |
0.67 |
COc1cc(\C=C(/C(O)=O)c2ccccc2)ccc1O |
|
| MolPort-046-158-470 |
0.67 |
Oc1ccc(\C=C/OC(=O)\C=C\c2ccc(O)c(O)c2)cc1O |
|
| MolPort-044-389-987 |
0.67 |
COc1ccc(C=CC(=O)OCC#N)cc1OC |
|
| MolPort-007-981-036 |
0.67 |
COC(=O)\C=C\c1ccc(OCC(C)C)c(OC)c1 |
|
| MolPort-044-387-451 |
0.67 |
COC(=O)C=Cc1ccc(OC(F)F)c(OC)c1 |
|
| MolPort-000-490-672 |
0.67 |
CCCCOc1ccc(\C=C\C(O)=O)cc1OC |
|
| MolPort-001-765-963 |
0.67 |
COc1cc(OC)c(\C=C\C(O)=O)cc1OC |
|
| MolPort-000-886-434 |
0.67 |
COc1cc(\C=C\C(O)=O)ccc1OCC(O)=O |
|
| MolPort-002-045-712 |
0.67 |
COc1ccc(\C=C(/S)C(O)=O)cc1 |
|
| MolPort-000-881-650 |
0.67 |
NC(=O)\C=C\c1ccc(O)cc1 |
|
| MolPort-019-999-364 |
0.67 |
Oc1ccc(C=Cc2cc(O)cc(O)c2)cc1 |
|
| MolPort-046-682-612 |
0.67 |
C\C(=C/c1ccc(OC(F)(F)F)cc1)C(O)=O |
|
| MolPort-006-067-440 |
0.67 |
CC(C)CCOc1ccc(\C=C\C(O)=O)cc1 |
|
| MolPort-003-850-143 |
0.67 |
Oc1ccc(\C=C/c2cc(O)cc(O)c2)cc1 |
|
| MolPort-002-940-801 |
0.67 |
COc1ccc2ccccc2c1\C=C\C(O)=O |
|
| MolPort-006-395-864 |
0.67 |
Oc1cc(O)cc(\C=C\[13c]2[13cH][13cH][13c](O)[13cH][13cH]2)c1 |
|
| MolPort-000-872-438 |
0.67 |
COc1ccc(\C=C(\S)C(O)=O)cc1 |
|
| MolPort-001-779-802 |
0.67 |
CCOC(=O)\C=C\c1ccccc1 |
|
| MolPort-028-923-980 |
0.67 |
COc1cc(\C=C\C(C)O)ccc1O |
|
| MolPort-002-691-403 |
0.67 |
CCCCOc1ccc(\C=C\C([O-])=O)cc1 |
|
| MolPort-000-148-424 |
0.67 |
OC(=O)\C=C\c1cccc(OCc2ccccc2)c1 |
|
| MolPort-005-226-471 |
0.67 |
OC(=O)C=Cc1cccc(OCc2ccccc2)c1 |
|
| MolPort-002-499-801 |
0.67 |
Oc1ccc(\C=C\c2cc(O)cc(O)c2)cc1 |
|
| MolPort-006-190-497 |
0.67 |
Oc1ccccc1\C=C\C=O |
|
| MolPort-009-209-092 |
0.67 |
CCOC(=O)C=Cc1ccccc1 |
|
| MolPort-027-354-644 |
0.67 |
CC(=Cc1ccc(OC(F)(F)F)cc1)C(O)=O |
|
| MolPort-023-329-829 |
0.67 |
COC(=O)\C=C\c1ccc(O)c(C=O)c1 |
|
| MolPort-001-956-083 |
0.67 |
CCCCOc1ccc(\C=C\C(O)=O)cc1 |
|
| MolPort-015-099-015 |
0.67 |
CCCOc1c(OC)cc(\C=C\C(O)=O)cc1OC |
|
| MolPort-004-946-890 |
0.67 |
Cc1ccccc1C=CC(O)=O |
|
| MolPort-001-833-795 |
0.67 |
C\C(=C/c1ccc(C)cc1)C(O)=O |
|
| MolPort-044-389-987 |
0.67 |
COc1ccc(C=CC(=O)OCC#N)cc1OC |
|
| MolPort-044-387-451 |
0.67 |
COC(=O)C=Cc1ccc(OC(F)F)c(OC)c1 |
|
| MolPort-020-108-592 |
0.67 |
COc1cc(C=C(C(O)=O)c2ccccc2)ccc1O |
|
| MolPort-046-158-470 |
0.67 |
Oc1ccc(\C=C/OC(=O)\C=C\c2ccc(O)c(O)c2)cc1O |
|
| MolPort-019-999-364 |
0.67 |
Oc1ccc(C=Cc2cc(O)cc(O)c2)cc1 |
|
| MolPort-046-682-612 |
0.67 |
C\C(=C/c1ccc(OC(F)(F)F)cc1)C(O)=O |
|
| MolPort-028-923-980 |
0.67 |
COc1cc(\C=C\C(C)O)ccc1O |
|
| MolPort-023-329-829 |
0.67 |
COC(=O)\C=C\c1ccc(O)c(C=O)c1 |
|
| MolPort-027-354-644 |
0.67 |
CC(=Cc1ccc(OC(F)(F)F)cc1)C(O)=O |
|
| MCULE-6773378809 |
0.67 |
C1=CC2CC1C1=C2C2CC1C1C(=O)OC(=O)C12 |
|
| MCULE-8879489618 |
0.67 |
C1CCCC2C(=O)OC(=O)C=2CCCCC1 |
|
| MCULE-7226046270 |
0.67 |
C12C(CCC(O)C=1)CC(C(OC)=O)C2 |
|
| MCULE-6875559589 |
0.67 |
C1(OC(C)=O)(CCC2C3C(C4CCC(CC4=CC3)C(OC)=O)CCC12)C(=O)COC(C)=O |
|
| MCULE-2531588252 |
0.67 |
[C@]12(C)C(=O)C=C3[C@@]([H])(CC[C@@]4([H])C[C@H](CC[C@]34C)OC(C)=O)C1C[C@@H]1O[C@]3(CC[C@@](CO3)([H])C)[C@@H](C)[C@H]21 |
|
| MCULE-8011378409 |
0.67 |
C1C[C@]2([C@]3([H])[C@@H](OC(=O)C)C[C@@]4(O)C(C([C@@]3(C4)CC[C@]2([H])[C@@](CO)(C)C1)=O)=C)C |
|
| MCULE-2786080368 |
0.67 |
[H][C@@]12OC(=O)C[C@]1([H])[C@@H](/C=C/[C@H](CCC1C=CC=CC=1)O)[C@H](O)C2 |
|
| MCULE-9707855350 |
0.67 |
[C@@]12([H])[C@H](CC(=CC(=O)[C@@]1(C)CC[C@@]2(O)C(C)C)C)OC(=O)C(C)=CC |
|
| MCULE-1044387998 |
0.67 |
C1(=O)CCC2(C)C3CCC4(C)C(OC(=O)CCC5CCCC5)CCC4C3CCC2=C1 |
|
| MCULE-9774427702 |
0.67 |
C1(C(O)=O)=C(C)C(OC21CCCCCC2)=O |
|
| MCULE-4242284738 |
0.67 |
C12(CCC(C3C(=O)OC(=O)C13)C=C2)C(=O)O |
|
| MCULE-7448178395 |
0.67 |
[C@H]12C(CCC(C)=C3CCC(C)(O)C13)C(C(=O)O2)C |
|
| MCULE-8303728984 |
0.67 |
[C@]12(C)CC[C@]3([C@@]([H])(CCC4=CC(=O)CC[C@]34C)[C@]1([H])C[C@@H](O)[C@]2(O)C(=O)COC(C)=O)[H] |
|
| MCULE-5563929213 |
0.67 |
C1=C(C)CC(C)(CC(O)(C)C(=O)O)OC1=O |
|
| MCULE-3343469308 |
0.67 |
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-9000317976 |
0.67 |
O=C(CCC1CCCC1)O[C@@H]1[C@]2(C)[C@@]([C@]3([C@@](CC2)([H])[C@]2(C)C(=CC(=O)CC2)CC3)[H])([H])CC1 |
|
| MCULE-5822421820 |
0.67 |
[C@]12(C)CCC(C=C1CC[C@]1([H])[C@]2([H])CC[C@]2([C@@]1([H])CC[C@@H]2OC(CCCCCCCCC)=O)C)=O |
|
| MCULE-7584425650 |
0.67 |
C1CC2(C)C(=O)OC(=O)C2(C)CC=1 |
|
| MCULE-7045925975 |
0.67 |
C12(C)CCC(C=C1CCC1C2CCC2(C1CCC2OC(CCC(C)C)=O)C)=O |
|
| MCULE-9323409980 |
0.67 |
[C@]12(C)CCC(C=C1CC[C@]1([H])[C@]2([H])CC[C@]2([C@@]1([H])CC[C@@H]2OC(CCC(C)C)=O)C)=O |
|
| MCULE-4494500718 |
0.67 |
[C@]12(C)C[C@H](O)[C@]3([C@@]([H])(CCC4=CC(=O)C=C[C@]34C)[C@]1([H])CC[C@]2(O)C(=O)COC(CC)=O)[H] |
|
| MCULE-5823109002 |
0.67 |
C1=CC2C3C=C(COC(=O)C)C3C1C1C(=O)OC(=O)C12 |
|
| MCULE-3325335892 |
0.67 |
[C@H]12OC(=O)C([C@@H]1[C@H](O)C[C@](O)(CCl)[C@]1([H])[C@H](O)C=C(C)[C@@]12[H])=C |
|
| MCULE-5014476622 |
0.67 |
[C@]12(O)C[C@@H]([C@@H]([C@@]1(C)CC[C@@]1([H])[C@@]2([H])CC[C@]2([C@]1(C=O)CC[C@H](O)C2)O)C1COC(=O)C=1)O |
|
| MCULE-4824360118 |
0.67 |
C12(OC(=O)C)CCC(=O)C=C1CCC1C3CCC(=O)C3(CCC21)C |
|
| MCULE-6887763526 |
0.67 |
[C@@]12([H])CCC3=CC(=O)C=C[C@]3(C)[C@@]1([H])[C@H](C[C@]1(C)[C@@](CC[C@@]21[H])(O)C(=O)COC(=O)/C=C(\C)/CC/C=C(\C)/CC/C=C(\C)/C)O |
|
| MCULE-7768501355 |
0.67 |
C1=CC2C3C(C)=C(COC(=O)C)C3C1C1C(=O)OC(=O)C12 |
|
| MCULE-8824249409 |
0.67 |
C1=CC2C3C=C(C4CC4)C3C1C1C(=O)OC(=O)C12 |
|
| MCULE-1602734224 |
0.67 |
O(C(CCCCCC)=O)[C@H]1CC[C@@H]2[C@]1(C)CC[C@@H]1[C@@]3(C)C(C)=CC(C[C@@H]3CC[C@@H]21)=O |
|
| MCULE-6680939605 |
0.67 |
C12(C)CC(O)C3C(CCC4=CC(=O)C=CC34C)C1CCC2(O)C(=O)COC(=O)C=CC |
|
| MCULE-1705600426 |
0.67 |
C12C(CCC(=O)C=1)CC(C(OC)=O)C2 |
|
| MCULE-9118663748 |
0.67 |
[C@]12(C)C(=O)C=C3C(CC[C@@]4([H])CC(CC[C@]34C)OC(CC)=O)C1CC1O[C@]3(CCC(CO3)C)[C@@H](C)C21 |
|
| MCULE-5874149529 |
0.67 |
[C@@]12([H])CCC3=CC(=O)CC[C@]3(C)[C@@]1([H])CC[C@]1(C)[C@H](CC[C@@]21[H])OC(=O)CCCCCCCCC |
|
| MCULE-1396534041 |
0.67 |
C[C@]12[C@@]3(OC3)[C@H](O[C@@]3(C=C(C(=O)[C@H](O)[C@]13CO)C)[H])[C@H](O)[C@H]2OC(=O)C |
|
| MCULE-8914845141 |
0.67 |
C(C)(=O)OC1CCC2(CO)C3CCC4(C)C(C5COC(C=5)=O)CCC4(O)C3CCC2(O)C1 |
|
| MCULE-8015339526 |
0.67 |
[C@]12(C)C[C@H](O)[C@]3([C@@]([H])(CCC4=CC(=O)C=C[C@]34C)[C@]1([H])CC[C@]2(O)C(=O)COC(CCCCCC)=O)[H] |
|
| MCULE-9191884874 |
0.67 |
C12(C)CC(OC(C)=O)C3C(CCC4=CC(=O)C=CC34C)C1C[C@@H](O)[C@]2(O)C(=O)COC(C)=O |
|
| MCULE-8274191901 |
0.67 |
[C@@]12(C)C[C@H]([C@]([H])([C@H](C(=O)O)CCC(=C)C(C)C)[C@@]1(C)CCC1[C@@]3(C)CC[C@H](OC(=O)C)C(C)(C)[C@]3([H])CCC2=1)O |
|
| MCULE-8399347131 |
0.67 |
[C@]12(O)CC[C@@H]([C@@]1(C)CCC1[C@@]2([H])CCC2[C@]1(C)CCC(=O)C2)C1COC(=O)C=1 |
|
| MCULE-5577107972 |
0.67 |
[Na+].C1(=O)C=C2[C@](C)(C=C1)[C@]1([H])[C@]([H])([C@@]3([H])[C@@](C[C@@H]1O)(C)[C@@](O)(C(=O)COC(=O)CCC([O-])=O)CC3)C[C@@H]2C |
|
| MCULE-8005661625 |
0.67 |
[C@H]1([C@@]2([H])CC(=O)O[C@@]2([H])C[C@H]1O)C=C[C@@H](O)CCC1C=CC=CC=1 |
|
| MCULE-5021218903 |
0.67 |
[C@]12(C)C[C@H](OC(C)=O)[C@]3([C@@]([H])(CCC4=CC(=O)C=C[C@]34C)[C@]1([H])C[C@@H](O)[C@]2(O)C(=O)COC(C)=O)[H] |
|
| MCULE-7772727437 |
0.67 |
C(C)(=O)OC1CCC2(C)C(C1)(CCC1C3CCC(C(C)C=CC(C)C(C)C)C3(C)CC(C2=1)=O)[H] |
|
| MCULE-3733595575 |
0.67 |
C(/C)(\C)=C/C1C(C)(C)C1C(=O)OC1CC(=O)C(CC=C)=C1C |
|
| MCULE-3449642272 |
0.67 |
O=C1CCC2(C)C3CCC4(C)C(O)(CCC4C3CC(C2=C1)OC(C)=O)C(COC(C)=O)=O |
|
| MCULE-3460278496 |
0.67 |
C12CCC(C=C1)CC2C(OCC)=O |
|
| MCULE-6163429552 |
0.67 |
[C@]12(C)C=CC(C=C1[C@H](C[C@@]1([H])C3[C@@](C)([C@@](CC3)(O)C(=O)COC(C)=O)CC(O)C21)C)=O |
|
| MCULE-7382046053 |
0.67 |
C1(C=C2[C@](C)(CC1)[C@]1([H])[C@]([H])([C@@]3([H])[C@@](CC1)(C)[C@@H](OC(=O)CCCCCC)CC3)CC2)=O |
|
| MCULE-5866611081 |
0.67 |
[C@]12(C)CCC(C=C1CCC1C2CC[C@]2(C1CCC2OC(CCC(C)C)=O)C)=O |
|
| MCULE-4909263569 |
0.67 |
C[C@]12CCC(=O)C=C1CC[C@@]1([H])[C@]3([H])CC[C@H](OC(=O)CCCCCCCCCC)[C@@]3(C)CC[C@]21[H] |
|
| MCULE-4678762535 |
0.67 |
C(C)(=O)OC1CCC2(COC(C)=O)C3CCC4(C)C(C5COC(C=5)=O)CCC4(O)C3CCC2(O)C1 |
|
| MCULE-6328864567 |
0.67 |
[C@]12(C)CC(O)C3[C@@]([H])(CCC4=CC(=O)C=C[C@]34C)C1CC[C@]2(O)C(=O)COC(=O)C(C)(C)C |
|
| MCULE-2233347949 |
0.67 |
[C@]12(C(C)=O)OCC[C@@]3(C1O)OC3C(=O)OC[C@@]13[C@]4([C@@H](C[C@@]([H])(O[C@]1([H])C=C(C)CC3)C14CO1)OC(=O)C=CCC2)C |
|
| MCULE-4877956227 |
0.67 |
[C@]12([H])[C@@H](O)C[C@]3(C)[C@@](CC[C@@]3([H])[C@]1([H])CCC1=CC(=O)C=C[C@]21C)(O)C(=O)COC(=O)C(C)(C)C |
|
| MCULE-9628114351 |
0.67 |
[C@]12(C)C[C@H](O)[C@@]3([C@@]4(C)C=CC(=O)C=C4CC[C@@]3([H])[C@@]1(CC[C@]2(O)C(=O)COC(=O)CC(C)(C)C)[H])[H] |
|
| MCULE-1714768829 |
0.67 |
CC(=O)OCC(=O)[C@@]1([C@]2(C)[C@@]([C@]3([C@@]([C@H](C2)O)([H])[C@]2(C)C(=CC(=O)C=C2)[C@@H](C)C3)[H])([H])CC1)O |
|
| MCULE-2899360955 |
0.67 |
[C@]12(C(=O)COC(C)=O)[C@H](O1)C[C@@]1([H])[C@]3([C@]([H])(CC[C@]21C)[C@@]1(C)CCC(C=C1CC3)=O)[H] |
|
| MCULE-7361919999 |
0.67 |
O1C(=O)C(=C)[C@]2([H])CCC(C)=C3[C@@]([H])([C@@]12[H])[C@@](O)(C)CC3 |
|
| MCULE-5462754937 |
0.67 |
[C@]12(C)CC(O)C3C(CCC4=CC(=O)C=C[C@]34C)C1CC[C@]2(O)C(=O)COC(CC)=O |
|
| MCULE-4772039176 |
0.67 |
[C@@]12([H])CCC3=CC(=O)CC[C@]3(C)[C@@]1([H])CC[C@]1(C)[C@H](CC[C@@]21[H])OC(=O)CCC1CCCC1 |
|
| MCULE-4659340446 |
0.67 |
[C@@]12([H])[C@H](CC(=CC(=O)[C@@]1(C)CCC2(O)C(C)C)C)OC(=O)C(C)=CC |
|
| MCULE-2748824939 |
0.67 |
C(C)(=O)OC1CCC2(C)C3CCC4(C)C(C5COC(C=5)=O)CCC4(O)C3CCC2(O)C1 |
|
| MCULE-3657670503 |
0.67 |
C12(C(=O)COC(C)=O)C(O1)CC1C3C(CCC21C)C1(C)CCC(C=C1CC3)=O |
|
| MCULE-5018857376 |
0.67 |
[C@]12(C)CC[C@]3([C@@]([H])(CCC4=CC(=O)CC[C@]34C)[C@]1([H])CC[C@]2(OC(C)=O)C(=O)COC(C)=O)[H] |
|
| MCULE-8924549531 |
0.67 |
C1C[C@]2(C)C3CC[C@]4(C)[C@@]([H])([C@H](C(O)=O)CCC(=C)C(C)C)[C@H](O)C[C@@]4(C)C=3CC[C@@]2([H])C(C)(C)[C@H]1OC(C)=O |
|
| MCULE-2384003351 |
0.67 |
C12(C)CCC(C=C1CCC1C2CCC2(C1CCC2OC(CCCCCCCCC)=O)C)=O |
|
| MCULE-4529602980 |
0.67 |
C1(=O)C=C2[C@](C)(CC1)[C@]1([H])[C@]([H])([C@@]3([H])[C@@](CC1)(C)[C@@H](OC(=O)CC)CC3)CC2 |
|
| MCULE-2901288503 |
0.67 |
C1(=O)C(=C)[C@]2([H])CCC(C)=C3CC[C@@](C)(O)[C@]3([H])[C@@]2([H])O1 |
|
| MCULE-5825350607 |
0.67 |
[C@@]12([H])C[C@@H](C3=CC(=O)C=C[C@]3(C)[C@@]1([H])[C@H](C[C@]1(C)[C@@](CC[C@@]21[H])(O)C(=O)COC(=O)C)O)C |
|
| MCULE-9186876350 |
0.67 |
C12(C)CCC3C(CCC4=CC(=O)CCC34C)C1CCC2(OC(C)=O)C(=O)COC(C)=O |
|
| MCULE-8699525011 |
0.67 |
[C@@]123CC[C@H]([C@@]1(O)CCC(C(=O)OC)=CC2)[C@@](C)(/C=C/C=C(\C)/C(=O)O)OC3=O |
|
| MCULE-1988011337 |
0.67 |
CC(OC([C@H]1[C@H]2C=C[C@H](CC2)C1)=O)C |
|
| MCULE-4882022453 |
0.67 |
COC1CC(OC(C2CCCC=2)=O)CC(OC)C1 |
|
| MCULE-6663461828 |
0.67 |
C1C=C(COC(C)=O)CC(OC(=O)C(C)CC)C2C(=C)C(=O)OC2C=C(CO)C1 |
|
| MCULE-1480805765 |
0.67 |
CCOC([C@H]1[C@H]2C=C[C@H](CC2)C1)=O |
|
| MCULE-5189438807 |
0.67 |
C1(C(C(/C=C(/C)\CCC2OC(=O)C=C2C)=O)C(C(C(C(O)/C=C(/C)\C)=O)C)CC1)C |
|
| MCULE-8627319345 |
0.67 |
[C@]12(C)CCC(C=C1CC[C@]1([H])[C@]2([H])CC[C@]2([C@@]1([H])CC[C@@H]2OC(CC)=O)C)=O |
|
| MCULE-1316925332 |
0.67 |
CC(OC(C1C2C=CC(CC2)C1)=O)C |
|
| MCULE-7442498630 |
0.67 |
C1(=O)C2C(C)C(C)=C(CC2C(=O)O1)/C=C(\C)/C |
|
| MCULE-3521079663 |
0.67 |
Cl.[C@]12(C)C[C@H](O)[C@]3([C@@]([H])(CCC4=CC(=O)CC[C@]34C)[C@]1([H])CC[C@]2(O)C(=O)COC(CN)=O)[H] |
|
| MCULE-9697672273 |
0.67 |
CC(OC(C1C2C=CC(CC2)C1)=O)(C)C |
|
| MCULE-8247739375 |
0.67 |
C12=CCC3C(C)(CCC4C(C(OC(C)=O)CCC34C)(C)C)C1(C)CCC1(CCC(C)C(C)C21)C(OC)=O |
|
| MCULE-9407663226 |
0.67 |
O=C(C12COCC1C2)C1CCCC=1 |
|
| MCULE-8496994310 |
0.67 |
COC(C[C@H](OC(C1CCCCC=1)=O)C)=O |
|
| MCULE-7388224086 |
0.67 |
C12C(CC(=C(C(C)CCCOC(C)=O)[C@H]1OC(C)=O)COC(C(C)C)=O)OC(=O)C2=C |
|
| MCULE-8613188927 |
0.67 |
CCCCCCC(O[C@@H]1[C@@]2(C)CC[C@@H]3[C@]4(C)C(=CC(CC4)=O)CC[C@H]3[C@@H]2CC1)=O |
|
| MCULE-5029800865 |
0.67 |
CC(OC([C@H]1[C@H]2C=C[C@H](CC2)C1)=O)(C)C |
|
| MCULE-3531606052 |
0.67 |
CC(C(O)=O)=CC=C[C@@]1(C)OC(=O)[C@]23CC=C(C(OC)=O)CC[C@]2(O)[C@H]1CC3 |
|
| MCULE-3402569698 |
0.67 |
C1C2COC(=O)C2C(C(O)=O)C(C)C=1 |
|
| MCULE-9972205159 |
0.67 |
C1C[C@]2([H])[C@@](C)(CCC3=CC(=O)OC3)[C@H](C)C[C@H](O)[C@@]2(COC(/C(=C/C)/C)=O)[C@@]2(CO2)C1 |
|
| MCULE-2858651865 |
0.67 |
O=C1C2C(C)CCC2C(C)C2=C1C(CCC1OC(=O)C(C)=C1)(C)OC2=O |
|
| MCULE-5275306349 |
0.67 |
C12CC(C(C(=O)OCC3CCCO3)C1C(O)=O)C=C2 |
|
| MCULE-1897292950 |
0.67 |
C1(=O)[C@@H](O)[C@]2(C)C3[C@@H](O)[C@@H]4OC(=O)[C@@H]([C@H]4C)[C@]3(C)C(=O)[C@H](O)[C@@]2([H])C(C)=C1 |
|
| MCULE-6426429596 |
0.67 |
O(C(C)=O)C1CC2C(=O)OCC=2C2(C)C1C1(COC1=O)CCC2 |
|
| MCULE-8920532684 |
0.67 |
[C@]12(O)[C@H](C)[C@@]3([H])CC[C@@](C)(O1)[C@]1([C@]([H])([C@@]4([H])[C@@](C1)([H])C(C(O)=O)=C[C@]1([H])[C@H]([C@H](C)[C@@H](O)[C@]41[H])OC(C)=O)[C@@]2([H])C(O3)=O)[H] |
|
| MCULE-2456274701 |
0.67 |
C1CC(O)(C2C(=O)OCC(C(O)=O)=CC2C1C(C)C)COC(/C(=C/C1C(C(C)C)CCC(CO)=C1)/CO)=O |
|
| MCULE-2089176275 |
0.67 |
C1C=C(C[C@H](OC(=O)C(CO)=C)[C@@H]2[C@H](OC(=O)C2=C)C=C(CO)C1)C |
|
| MCULE-3608441851 |
0.67 |
C12(C)CCC3(C([H])(CCC4=CC(=O)CCC43[H])C1([H])CCC2OC(CCCCCCCCC)=O)[H] |
|
| MCULE-8407720746 |
0.67 |
C1(C=C2[C@](C)(CC1)[C@]1([H])[C@]([H])([C@@]3([H])[C@@](CC1)(C)[C@@H](OC(=O)CCCCCCCCCC)CC3)CC2)=O |
|
| MCULE-8392201259 |
0.67 |
C[C@@]12[C@@H](OC(=O)CCCCCCCCC)CC[C@]1([C@]1([C@]([C@@]3(C(=CC(=O)CC3)CC1)[H])([H])CC2)[H])[H] |
|
| MCULE-5488659453 |
0.67 |
C12(C)CCC(C=C1CCC1C2CCC2(C1CCC2OC(CC)=O)C)=O |
|
| MCULE-1316729655 |
0.67 |
CC=C(C)C(OC1CC2C(CC3(C)C(C2CC1(C)C)=CCC1C3(CCC2C1CCCC2(CO)C)C)O)=O |
|
| MCULE-3821215089 |
0.67 |
C1C[C@@]2([C@]3(COC(/C(=C/C)/C)=O)[C@@H](OC(C)=O)C[C@@H](C)[C@](C)(CCC4=CC(=O)OC4)[C@@]3([H])C1)CO2 |
|
| MCULE-5179814934 |
0.67 |
C1(C)=C[C@@]2([H])O[C@]3([H])[C@H](O)[C@@H](OC(C)=O)[C@@](C)([C@]43OC4)[C@@]2(CO)[C@H](O)C1=O |
|
| MCULE-6383206380 |
0.67 |
O=C1C=CC2(C)C3C(O)CC4(C)C(O)(CCC4C3CC(C)C2=C1)C(COC(C)=O)=O |
|
| MCULE-6913740702 |
0.66 |
O=C1CCC2(C)C3CCC4(C)C(CCC4C3CCC2=C1)C(C)([H])OC(C)=O |
|
| MCULE-2394088414 |
0.66 |
[C@]12(C)CC(=O)[C@]3([C@@]([H])(CCC4=CC(=O)C=C[C@]34C)[C@]1([H])CC[C@]2(O)C(=O)COC(CCC(O)=O)=O)[H] |
|
| MCULE-9650544498 |
0.66 |
[C@]12([H])CC[C@]3(C)[C@H](CC[C@@]3([H])[C@]1([H])CCC1=CC(=O)CC[C@]21C)OC(=O)C |
|
| MCULE-2185195019 |
0.66 |
[C@@H]1(OC(C)=O)[C@@H](C(C)C)[C@@H](OC(=O)/C(/C)=C/C)C=C(CO)C1=O |
|
| MCULE-5172881076 |
0.66 |
C12(O)CCC(C3COC(=O)C=3)C1(C)CCC1([H])C2([H])CCC2(O)CC(CCC12C=O)OC(CBr)=O |
|
| MCULE-9997097977 |
0.66 |
C12(C)CC(O)C3C(CCC4=CC(=O)CCC34C)C1CC[C@]2(O)C(=O)COC(CCl)=O |
|
| MCULE-5446385915 |
0.66 |
C(C)(=O)OC1CC2C(C=C3C4CC=C(C4(C)CC(C3C2(C)CC1)=O)C(C)=O)=O |
|
| MCULE-2088102696 |
0.66 |
[C@H]12[C@H](CC3[C@@](C)(C([H])(C)CCC=3)C1([H])O)OC(=O)C2=C |
|
| MCULE-1444566715 |
0.66 |
C1([C@]2(C)C3[C@@H](O)[C@@H]4OC(=O)[C@@H]([C@H]4C)[C@]3(C)C(=O)C=C2C(C)C1)=O |
|
| MCULE-5172373620 |
0.66 |
C1(C)(CC2CC1C=C2)C(OCCCCCl)=O |
|
| MCULE-2971132760 |
0.66 |
C1(C)(CC2CC1C=C2)C(OCCCCBr)=O |
|
| MCULE-8543972286 |
0.66 |
C12CC(C(C)C1C(OCCCCCl)=O)C=C2 |
|
| MCULE-3173207342 |
0.66 |
C(O[C@@H]1[C@]2(C)[C@H]([C@H]3[C@H](CC2)[C@]2(C)C(=CC(=O)CC2)CC3)CC1)(=O)C |
|
| MCULE-9996412338 |
0.66 |
C12OC(=O)C(C)(C3C(C(O)=O)C45CC(=C)C(O)(CCC4C3=C1)C5)C2O |
|
| MCULE-3758685184 |
0.66 |
O(C(C)=O)[C@H]1CC[C@@H]2[C@]1(C)CC[C@@H]1[C@@]3(C)C(C)=CC(C[C@@H]3CC[C@@H]21)=O |
|
| MCULE-3930398727 |
0.66 |
C1C=C(C)CC[C@H]2C(=C)C(=O)O[C@@H]2[C@@H]2O[C@@]2(C1)C |
|
| MCULE-4401364485 |
0.66 |
C1C[C@]2(C)C3CC[C@]4(C)[C@@](O)(C5COC(=O)C=5)CC[C@]4(O)C3CCC2C[C@H]1O |
|
| MCULE-6440147345 |
0.66 |
O1C(C2=CCCCC2C1CCCC)=O |
|
| MCULE-8810317888 |
0.66 |
C1(=O)C(C2CCCCC2)=C(C(=O)O1)C1CCCCC1 |
|
| MCULE-2220797118 |
0.66 |
C1(CCC(=O)/C=C/[C@@H]2[C@@H]3[C@H](C[C@H]2O)OC(=O)C3)=CC=CC=C1 |
|
| MCULE-8836163795 |
0.66 |
C12CC3CC4CC5C(=O)OC(=O)C=5CC=4CC=3CC=1C(OC2=O)=O |
|
| MCULE-5711398890 |
0.66 |
C1C[C@@]2([C@@]([H])([C@@](C1)(C(O)=O)C)CC[C@@]13C[C@@](CC[C@@]21O)([H])C(=C)[C@@H]3OC(=O)/C(/C)=C\C)C |
|
| MCULE-2982639627 |
0.66 |
[C@H]1(C[C@]2(C)C(=CC(=O)O2)C(C)(C)C1)O |
|
| MCULE-1187896247 |
0.66 |
[C@H]12[C@@H]3[C@@H](CCC(=CCC[C@]1(O2)C)C)C(C(=O)O3)=C |
|
| MCULE-7138852957 |
0.66 |
[C@@]12([H])[C@@]([H])(CC3[C@@](C)(C([H])(C)CCC=3)C1([H])O)OC(=O)C2=C |
|
| MCULE-5883474591 |
0.66 |
C12=CC(=O)[C@]3([C@](C)(C[C@H]4[C@@H](C3)OC(C)(C)O4)C1CC[C@]1(C)C(CC[C@@]21O)[C@]1(C)C(CCC(C)(C)OC(C)=O)OC(C)(C)O1)[H] |
|
| MCULE-4184770590 |
0.66 |
[C@]12(O)CC[C@@H]([C@@]1(C)CC[C@@]1([H])[C@@]2([H])CC[C@]2([C@]1(C=O)CC[C@H](OC(CBr)=O)C2)O)C1COC(=O)C=1 |
|
| MCULE-5499634167 |
0.66 |
CC1C(=O)OC2C1CCC(O)(C)C1C2=C(C)C2C1C1C3C(O)(C)CCC4C(C)C(=O)OC4C23C(C)=C1 |
|
| MCULE-9952768892 |
0.66 |
C1(=O)CC2C(C(=C1)COC(=O)C)(C)CCC(C)C2(CCC(CC(O)=O)C)C |
|
| MCULE-5854292644 |
0.66 |
C12(O)CCC(C1(C)CCC1([H])C2([H])CCC2C1(C=O)CCC(O)C=2)C1COC(=O)C=1 |
|
| MCULE-1065163743 |
0.66 |
[C@]12([H])[C@@H](O)C[C@]3(C)[C@H](CC[C@@]3([H])[C@]1([H])CCC1=CC(=O)CC[C@]21C)C(=O)COC(=O)C |
|
| MCULE-6512230417 |
0.66 |
[C@]12([H])O[C@]1(C)CCC=C(C)CC[C@@]1([H])C(C(=O)O[C@]21[H])=C |
|
| MCULE-1759828525 |
0.66 |
[C@H]12[C@@]([H])(CCC(C)=C3C(CC(C)[C@]13[H])=O)[C@@H](C(=O)O2)C |
|
| MCULE-4774272300 |
0.66 |
[C@@H]12[C@@H]3[C@@H](CCC(=CCC[C@]1(O2)C)C)C(C(=O)O3)=C |
|
| MCULE-3087856332 |
0.66 |
[C@]12(O)CC[C@@H]([C@@]1(C)CCC1C2CCC2[C@]1(C=O)CC[C@H](O)C=2)C1COC(=O)C=1 |
|
| MCULE-3922449822 |
0.66 |
O=C1C2CC(C=CC2)O1 |
|
| MCULE-1091339345 |
0.66 |
O=C(C1CCCCCC=1)OC1COCC1 |
|
| MCULE-4325006445 |
0.66 |
[C@@H]1(O)C(=O)[C@]2(C)[C@@]3([H])C(=O)C(OC)=C(C)[C@]4([H])CC(=O)O[C@@]([H])([C@]34C)C[C@@]2([H])[C@H](C)C1 |
|
| MCULE-2156810295 |
0.66 |
[C@]12(C)CCC(C=C1[C@@H](C)CC1C3[C@@](C)([C@@](CC3)(O)C(=O)COC(C)=O)CC=C21)=O |
|
| MCULE-7648693618 |
0.66 |
[C@]12(C)CC=C3C(CCC4=CC(=O)C=C[C@]34C)C1CC[C@]2(OC(C)=O)C(=O)COC(C)=O |
|
| MCULE-4660404446 |
0.66 |
C1C[C@@]2([C@]3(COC(C)=O)[C@@H](OC(C)=O)C[C@@H](C)[C@](C)(C[C@H](OC(=O)C(C)CC)C4=CC(=O)OC4)[C@@]3([H])C1)CO2 |
|
| MCULE-4446927847 |
0.66 |
[C@H]1(O)C[C@]2(C)[C@]34O[C@H]3[C@@H]3O[C@]3(C(C)C)[C@@H](O)[C@]34O[C@H]3C[C@@]2([H])C2COC(=O)C1=2 |
|
| MCULE-1120014260 |
0.66 |
[C@@]12([H])OC(=O)C([C@@]1([H])CC=C([C@@H](OC(=O)C)CC(=O)C)[C@@H](C)C2)=C |
|
| MCULE-6443674630 |
0.66 |
C1=CC2C3C(COC(=O)C)=C(COC(=O)C)C3C1C1C(=O)OC(=O)C12 |
|
| MCULE-1850569909 |
0.66 |
[C@]12(C)CCC3[C@@]([H])(CCC4=CC(=O)CCC43)C1CC[C@@H]2OC(C)=O |
|
| MCULE-9070200931 |
0.66 |
C1C=C(C)CC(O)C2C(COC)C(=O)OC2C2OC2(C)C1 |
|
| MCULE-7181833804 |
0.66 |
C1C=C(C[C@@H]([C@@H]2[C@H](OC(C2=C)=O)C=C(CO)C1)OC(=O)C(=C)C(CO)O)C |
|
| MCULE-4640608487 |
0.66 |
C12(C)CC(O)C3C(CCC4=CC(=O)CCC34C)C1CCC2(O)C(=O)COC(CCl)=O |
|
| MCULE-4118307977 |
0.66 |
[C@]12(C)CC(C(OC)=O)[C@]3([C@@]([H])(CCC4=CC(=O)C=C[C@]34C)[C@]1([H])C[C@@H](O)[C@]2(O)C(=O)COC(C)=O)[H] |
|
| MCULE-8798786679 |
0.66 |
C1(C(O)=O)C2C=CC(O2)C1C(O)=O |
|
| MCULE-4935129848 |
0.66 |
C12=CC[C@]3(C(CC[C@]3(O)C(=O)COC(C)=O)C1CCC1=CC(=O)CC[C@]21C)C |
|
| MCULE-5648274394 |
0.66 |
CC1CCC2C(C(OC2C2OC2(C)CCC=1)=O)=C |
|
| MCULE-3035603698 |
0.66 |
C(CC(C)CC)(OC1C(C(CO)=CC(OC(C)=O)C1C(C)C)=O)=O |
|
| MCULE-1499638877 |
0.66 |
CC(C(C1C(CC2C(O)C(O)C(CC(=CC(OCCCCCCCCC(=O)O)=O)C)OC2)O1)C)O |
|
| MCULE-2472883269 |
0.66 |
OC(C12COCC1C2)C1CCCC=1 |
|
| MCULE-1550349961 |
0.66 |
C12(C)CCC3C(CC=C4CC(CCC34C)OC(C)=O)C1CC=C2C(O)CCOC(C)=O |
|
| MCULE-5045812758 |
0.66 |
C(=O)(OC1C(C(C=C(C1=O)CO)OC(C)=O)C(C)C)CC(C)C |
|
| MCULE-8451955222 |
0.66 |
[C@@H]1(O)[C@@H](O)[C@]2(C)C3[C@@H](O)[C@@H]4OC(=O)[C@@H]([C@H]4C)[C@]3(C)C(=O)C=C2[C@H](C)C1 |
|
| MCULE-9616259526 |
0.66 |
C12CCCCCC=1C(=O)OC2=O |
|
| MCULE-1524945873 |
0.66 |
C1C[C@]2([H])[C@@](C)(CCC3=CC(=O)OC3)[C@H](C)CC[C@@]2(C)C(C(=O)OC)=C1 |
|
| MCULE-5708067201 |
0.66 |
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-7557744061 |
0.66 |
C1CC2(C)OC2CC2C(CC3(C)OC13)OC(=O)C=2C |
|
| MCULE-2660227283 |
0.66 |
C12(C)CC=C3C(CCC4([H])CC(=O)CCC34C)C1CC(C)C2(O)C(=O)COC(C)=O |
|
| MCULE-4994703608 |
0.66 |
C12C3C(OC(C)(C)C)C4C(C3C(C(=O)OC)=C1C(=O)OC)C24 |
|
| MCULE-2702437708 |
0.66 |
C12([H])CC3C(C=C(C)C1([H])C(CC2(C)O)OC(C)=O)OC(=O)C3=C |
|
| MCULE-8187072901 |
0.66 |
C1(OC)C(=O)[C@]2(C)[C@@]3([H])C(=O)C(OC)=C(C)[C@]4([H])CC(=O)O[C@@]([H])([C@]34C)C[C@@]2([H])[C@H](C)C=1 |
|
| MCULE-7405855960 |
0.66 |
O=C1C(=C)[C@@]2(CCC(=CCC[C@]3(O[C@]3([H])[C@@]2([H])O1)C)C)[H] |
|
| MCULE-5549232456 |
0.66 |
[C@]12(C)CC=C3[C@@]([H])(CC[C@@]4([H])CC(=O)CC[C@]34C)C1C[C@@H](C)[C@]2(O)C(=O)COC(C)=O |
|
| MolPort-002-855-009 |
0.66 |
COc1cc(C=C(C(C)=O)C(C)=O)ccc1O |
|
| MCULE-1014190195 |
0.66 |
C1(OCC(=C1C)CCCCC(=O)O)=O |
|
| MolPort-011-018-577 |
0.66 |
CCOc1cc(C=CC(O)=O)ccc1OCc1ccccc1 |
|
| MCULE-5937685751 |
0.66 |
[C@@]12([H])C[C@H]3C(C=C(C)[C@@]1([H])[C@H](C[C@@]2(C)O)OC(C)=O)OC(=O)C3=C |
|
| MolPort-000-860-998 |
0.66 |
CCOC(=O)\C=C\c1ccc2OCOc2c1 |
|
| MCULE-6921575032 |
0.66 |
C1(O)(CC2C=CC(O2)C1)CC(OC)=O |
|
| MolPort-000-886-517 |
0.66 |
CCOc1cc(\C=C\C(O)=O)ccc1OCC(O)=O |
|
| MCULE-7068002290 |
0.66 |
C1(O)(CC2C=CC(O2)C1)C(C)C(OC)=O |
|
| MolPort-044-258-721 |
0.66 |
COCCOc1ccc(C=CC(=O)OC)cc1OC |
|
| MCULE-5325377420 |
0.66 |
O=C(CCCCCCCCOC(=O)/C=C(/C[C@H]1[C@H](O)[C@H](O)[C@@H](C[C@H]2[C@H]([C@@H](C)[C@H](C)O)O2)CO1)\C)O |
|
| MolPort-002-887-752 |
0.66 |
COc1ccc(\C=C(\C#N)C(O)=O)cc1 |
|
| MolPort-046-688-825 |
0.66 |
COC(=O)\C=C\c1ccc(OCc2ccccc2)c(O)c1 |
|
| MolPort-035-807-725 |
0.66 |
COc1cc(\C=C\C(O)=O)ccc1OCc1cccc2ccccc12 |
|
| MolPort-044-376-563 |
0.66 |
COC(=O)C(=Cc1ccc(O)c(OC)c1)C#N |
|
| MolPort-020-355-053 |
0.66 |
C\C(=C/C(O)=O)c1ccc2ccccc2c1 |
|
| MolPort-020-358-111 |
0.66 |
Cc1ccc(COc2cccc(\C=C\C(O)=O)c2)cc1 |
|
| MolPort-035-807-948 |
0.66 |
OC(=O)\C=C\c1cccc(OCc2cccc3ccccc23)c1 |
|
| MolPort-022-250-717 |
0.66 |
COc1ccc(\C=C\C(O)=O)cc1N |
|
| MolPort-028-750-497 |
0.66 |
OC(=O)C=Cc1ccc(OCc2ccccc2)cc1 |
|
| MolPort-001-017-640 |
0.66 |
COC(=O)C(=C\c1ccc(O)cc1)\C#N |
|
| MolPort-000-672-007 |
0.66 |
COc1ccc(\C=C\C(O)=O)c(OC)c1 |
|
| MolPort-028-750-497 |
0.66 |
OC(=O)C=Cc1ccc(OCc2ccccc2)cc1 |
|
| MolPort-000-420-058 |
0.66 |
COc1ccc(\C=C(/C#N)C(O)=O)cc1 |
|
| MolPort-022-250-717 |
0.66 |
COc1ccc(\C=C\C(O)=O)cc1N |
|
| MolPort-006-113-339 |
0.66 |
COc1cc(\C=C\CO)cc(OC)c1OC |
|
| MolPort-000-886-511 |
0.66 |
CCCCOc1ccc(\C=C\C(O)=O)cc1OCC |
|
| MolPort-044-390-786 |
0.66 |
COc1ccc(OC(=O)C=Cc2ccc(OC)c(OC)c2)cc1 |
|
| MolPort-000-886-562 |
0.66 |
CCOc1cc(\C=C\C(O)=O)ccc1OCc1ccccc1 |
|
| MolPort-004-290-837 |
0.66 |
OC(=O)\C=C\c1cc(Cl)ccc1O |
|
| MolPort-001-763-903 |
0.66 |
OC(=O)\C=C\c1ccc(OCc2ccccc2)cc1 |
|
| MolPort-001-845-252 |
0.66 |
COc1ccc(C=CC(O)=O)c(OC)c1 |
|
| MolPort-010-998-145 |
0.66 |
COc1ccc(C=C(C#N)C(O)=O)cc1 |
|
| MolPort-020-358-111 |
0.66 |
Cc1ccc(COc2cccc(\C=C\C(O)=O)c2)cc1 |
|
| MolPort-035-807-948 |
0.66 |
OC(=O)\C=C\c1cccc(OCc2cccc3ccccc23)c1 |
|
| MolPort-046-688-825 |
0.66 |
COC(=O)\C=C\c1ccc(OCc2ccccc2)c(O)c1 |
|
| MolPort-005-982-954 |
0.66 |
COc1ccc(\C=C\CO)cc1 |
|
| MolPort-020-355-053 |
0.66 |
C\C(=C/C(O)=O)c1ccc2ccccc2c1 |
|
| MolPort-003-665-148 |
0.66 |
COC(=O)\C=C\c1ccc2ccccc2c1 |
|
| MolPort-002-852-306 |
0.66 |
COC(=O)\C=C/c1cccc2ccccc12 |
|
| MolPort-000-860-801 |
0.66 |
COC(=O)\C=C\c1c2ccccc2cc2ccccc12 |
|
| MolPort-006-067-526 |
0.66 |
Cc1ccc(\C=C\C(O)=O)cc1C |
|
| MolPort-001-824-038 |
0.66 |
COc1ccc(\C=C\C(C)=O)cc1OC |
|
| MolPort-006-826-178 |
0.66 |
COc1cc(F)cc(\C=C\C(O)=O)c1 |
|
| MolPort-002-823-347 |
0.66 |
COc1cc(\C=C\C(N)=O)ccc1O |
|
| MolPort-044-390-786 |
0.66 |
COc1ccc(OC(=O)C=Cc2ccc(OC)c(OC)c2)cc1 |
|
| MolPort-000-894-438 |
0.66 |
COc1ccc(\C=C\C(O)=O)cc1Cl |
|
| MolPort-035-807-725 |
0.66 |
COc1cc(\C=C\C(O)=O)ccc1OCc1cccc2ccccc12 |
|
| MolPort-005-220-393 |
0.66 |
COc1cc(C=CC(O)=O)cc(Cl)c1OC |
|
| MolPort-018-618-316 |
0.66 |
OC(=O)\C=C\c1ccc(OCc2ccccc2)c(OCc2ccccc2)c1 |
|
| MolPort-044-258-721 |
0.66 |
COCCOc1ccc(C=CC(=O)OC)cc1OC |
|
| MolPort-001-811-938 |
0.66 |
COc1ccc(\C=C\C(O)=O)cc1OCc1ccccc1 |
|
| MolPort-009-796-044 |
0.66 |
CCOC(=O)C=Cc1ccc2OCOc2c1 |
|
| MolPort-001-017-639 |
0.66 |
COC(=O)C(=C\c1ccc(O)c(OC)c1)\C#N |
|
| MolPort-000-490-706 |
0.66 |
COc1cc(\C=C\C(O)=O)cc(Cl)c1OC |
|
| MolPort-044-376-563 |
0.66 |
COC(=O)C(=Cc1ccc(O)c(OC)c1)C#N |
|
| MolPort-000-492-384 |
0.66 |
CCOc1cc(\C=C\C(O)=O)ccc1OC(F)F |
|
| MCULE-3052348589 |
0.66 |
C1(=O)O[C@@H]2[C@@H]([C@@H](CC(C)=CC[C@H](OC(C)=O)C(C)=C2)OC(=O)/C(=C/C)/COC(=O)/C(/CO)=C/C)C1=C |
|
| MCULE-1584743999 |
0.66 |
[C@]1([H])(C[C@H]2CO[C@@H](CC(C)=CC(=O)OCCCCCCCCC(=O)O)[C@H](O)[C@@H]2O)O[C@@]1([H])[C@@H](C)[C@@H](O)C |
|
| MCULE-5198741898 |
0.66 |
[C@H]1(O)[C@@H](O)[C@H](CC(C)=CC(=O)OCCCCCCCCC(=O)O)OC[C@]1([H])C[C@H]1[C@@]([C@@H](C)[C@@H](O)C)([H])O1 |
|
| MCULE-5241313012 |
0.66 |
C12(C)CCC(C=C1CCC1C2CCC2(C1CCC2OC(C)=O)C)=O |
|
| MCULE-9340600776 |
0.66 |
C1C(C(CCC=1C)CC(=O)OCC)=O |
|
| MCULE-3713246373 |
0.66 |
[C@]12(O)CC[C@@H]([C@@]1(C)CC[C@@]1([H])[C@@]2([H])CC[C@]2([C@]1(C=O)CC[C@H](OC(CCl)=O)C2)O)C1COC(=O)C=1 |
|
| MCULE-5753734207 |
0.66 |
C1CC2C(CCC3OC(=O)CC(O)C3)C(C)C=CC2CC1 |
|
| MCULE-4551637584 |
0.66 |
C1CC2(C)C3C(OC)C=C4C5C(C)C(C)CCC5(C)CCC4(C)C3(C)CCC2C(C(=O)O)(C)C1OC(=O)C |
|
| MCULE-8334353275 |
0.66 |
O=C1CCC2(C)C3C4CC5(C(O)O4)C(CCC5C3CCC2=C1)C(COC(C)=O)=O |
|
| MCULE-2674516333 |
0.66 |
C1(CC2CC1C=C2)C(OCCCCBr)=O |
|
| MCULE-2094560228 |
0.66 |
C1=C[C@]2(C)[C@]3([H])CC[C@@]4([H])/C(=C(\C(O)=O)/CC/C=C(\C)/C)/[C@H](C[C@]4(C)[C@]3(C([C@@H](O)[C@@]2([H])[C@H](C)C1=O)=O)C)OC(=O)C |
|
| MCULE-9705843453 |
0.66 |
C12(C)OC(=O)C3(C(OC(C3(C1=C)C1(C(C2)C2(C)C=CC(=O)C(C)(C)C2CC1)C)=O)C)O |
|
| MCULE-6459621832 |
0.66 |
[C@]12(C)C[C@H](O)[C@@]3([H])[C@@]([H])(CCC4=CC(=O)C=C[C@]34C)[C@]1([H])C[C@@H](O)[C@]2(O)C(=O)COC(C)=O |
|
| MCULE-9289500370 |
0.65 |
C1(=C(CCC(O)=O)[C@](O)(C)[C@@H]2OC(=O)C(=C)[C@@H]2CC1)C |
|
| MCULE-8902402936 |
0.65 |
CC1([C@@H]2C(COC(C3C4OC(CC4)C3)=O)=CC[C@H]1C2)C |
|
| MCULE-4687597526 |
0.65 |
C1C[C@]2(C)[C@@]3([H])[C@H](OC(C)=O)[C@@H](OC(=O)CC(C)C)[C@]4(C)[C@@]([H])(C(C)=O)CC[C@]4(O)C3CC=C2C[C@H]1O |
|
| MCULE-1428350503 |
0.65 |
C12C(O)OC(=O)C=1CC(O)(C)C1CC(C)(C)CC1C2O |
|
| MCULE-4565271647 |
0.65 |
C12CCC(C(=O)COC(=O)CCC(=O)O)C1(C)CCC1C3(C)CCC(=O)C=C3CCC21 |
|
| MCULE-3176715940 |
0.65 |
CC1CC(C)(C)CC(OC(CC2OCCC2)=O)C=1 |
|
| MCULE-1400269697 |
0.65 |
C1(=O)CCC(=O)C(C1)(C/C=C(\C)/CC/C=C(\C)/C(=O)OC)CC(=O)OC |
|
| MCULE-3930781117 |
0.65 |
O=C(C12COCC1C2)C1CCCCC=1 |
|
| MCULE-5998876996 |
0.65 |
O(C(C)=O)[C@H]1CC[C@@]2(C)[C@H](C1(C)C)CC[C@@]1(C)[C@]3(C)CC[C@@]4(C(=O)O)CCC(C)(C)C[C@H]4C3=CC[C@@H]12 |
|
| MCULE-7768079101 |
0.65 |
O1[C@H](C)CCCC=C[C@@]2([H])C[C@@H](O)C[C@]2([H])[C@H](C=CC1=O)O |
|
| MCULE-5727001856 |
0.65 |
O=C(C12COCC1C2)C1CCCCCC=1 |
|
| MCULE-4347715073 |
0.65 |
C1(C(OC)=O)=C(O)CC2CC3(OCC(CO3)(C)C)CC12 |
|
| MCULE-4987010609 |
0.65 |
OC(C1C2C=CC(O2)C1)=O |
|
| MCULE-2286713902 |
0.65 |
C1C(OC(C)=O)C2(C(CC3C(OC(=O)C=3C)C2)C(=C)C1)C |
|
| MCULE-6137852908 |
0.65 |
C(O[C@@H]1[C@@]2(O)[C@H](O)C(COC(C)=O)=C[C@]3([H])C(=O)[C@]2(C=C1C)[C@H](C)C[C@@]1([H])C(C)(C)[C@]13[H])(=O)/C(/C)=C\C |
|
| MCULE-4810985269 |
0.65 |
[C@@]12([H])OC(=O)C([C@@]1([H])CC=C(/C=C/C(=O)C)[C@@H](C)C2)=C |
|
| MCULE-3320650867 |
0.65 |
C1(CCC=C(C)CCC2C(C=C(CCC=1)C)OC(=O)C2=C)C(=O)O |
|
| MCULE-7364536785 |
0.65 |
C(/C(=C/C)/C)(O[C@H]1C(=O)C(CO)=C[C@H](OC(C)=O)[C@@H]1C(C)C)=O |
|
| MCULE-2403352810 |
0.65 |
C12=CC[C@]3([H])[C@@]4(C)CC[C@H](OC(C)=O)C(C)(C)[C@@]4(CC[C@@]3(C)[C@]1(C)CC[C@]1(CC[C@@H](C)[C@H](C)[C@@]21[H])C(O)=O)[H] |
|
| MCULE-2054566768 |
0.65 |
[C@@]12(C)CC[C@]3(CCC(C)(C)C[C@@]3([H])C1=CC[C@]1([H])[C@@]3([C@]([H])(C(C)(C)[C@H](CC3)OC(C)=O)CC[C@@]21C)C)C(O)=O |
|
| MCULE-8342852060 |
0.65 |
C1C2(C(=O)OC(C)(C2(O)/C=C/C(/C)=C/C(=O)O)CC1O)C |
|
| MCULE-8750855908 |
0.65 |
C1[C@]([H])(C/C=C(\C)/CC2CC(C)C(=O)O2)C(C(O1)=O)=C |
|
| MCULE-2358670355 |
0.65 |
O=C1C=C2[C@@]3(C4[C@](C=C2)([H])[C@@]2([H])[C@]([C@@](CC2)(CCC(=O)O)O)(C(=O)OC3)CC4)CC1 |
|
| MCULE-6449749404 |
0.65 |
[C@H]12[C@@H](C=C(C)CCC=C(C=O)[C@H](OC)[C@H]1OC(C(C)C)=O)OC(=O)C2=C |
|
| MCULE-8245989851 |
0.65 |
C12CC(C=C1)C(C(OC)=O)C2C(O)=O |
|
| MCULE-1898871437 |
0.65 |
C12CC(CC1C=CCCCC(C)OC(=O)C=CC2O)O |
|
| MCULE-3829637819 |
0.65 |
C12C(OC(=O)C)C(C)C(O)C1C1C3C4C(=O)OC5CCC(C)(OC4(OC)C5C)C3CC1C(C(=O)O)=C2 |
|
| MCULE-7141669330 |
0.65 |
C1=C[C@]2(O)CCO[C@]2([H])CC1=O |
|
| MCULE-3094170088 |
0.65 |
O=C1C=C[C@@H](O)[C@@]2([H])[C@](C[C@@H](C2)O)([H])C=CCCC[C@H](C)O1 |
|
| MCULE-9315688246 |
0.65 |
C1CC23C4C=C(C)C5(C(C(=C(C5=O)C)O)(C4(CCC2C(C)(C1OC3=O)C)C)C(OC)=O)C |
|
| MCULE-3358579622 |
0.65 |
O=C(OCC1CCCO1)C1CC2CC1C=C2 |
|
| MCULE-4347835968 |
0.65 |
[C@@]12([H])CC[C@H](O)[C@@]1(C)[C@@H](O)[C@@H]1C(=C)C(=O)O[C@H]1C[C@H]2C |
|
| MCULE-3941648652 |
0.65 |
C1(C(O)=O)=C(C)C(OC21CCCCC2)=O |
|
| MCULE-7343644414 |
0.65 |
C[C@@]12CC[C@@]3([H])C([C@@H](OC(=O)CCC(=O)O)CC[C@]3(C)C1=CC[C@]1([H])[C@]3([H])C[C@@](C)(C(=O)O)CC[C@]3(C)CC[C@@]21C)(C)C |
|
| MCULE-1228200157 |
0.65 |
C1[C@@]2([H])[C@H](O)C=CC(=O)O[C@@H](C)CCCC=C[C@]2([H])C[C@@H]1O |
|
| MCULE-6245044746 |
0.65 |
[C@]12(C)CC(=O)[C@]3([C@@]([H])(CCC4=CC(=O)C=C[C@]34C)[C@]1([H])CC[C@]2(O)C(=O)COC(C)=O)[H] |
|
| MCULE-5497851720 |
0.65 |
C(=O)(OC1CC(C)CCC1C(C)C)C1CC=C(C(=O)OC2CC(C)CCC2C(C)C)CC=1 |
|
| MCULE-9801536119 |
0.65 |
C1(C(OCC)=O)C2CCC(C2(C)C)(C)C=1 |
|
| MCULE-1983952062 |
0.65 |
C1[C@@H](C)[C@]2([H])[C@]3(CC=C(C)C(=O)[C@H]3O)[C@@](O)(C)O[C@]2([H])C(=O)O1 |
|
| MCULE-2014104728 |
0.65 |
[C@]12(C)CC=C3[C@@]([H])(CCC4=CC(=O)C=C[C@]34C)C1C[C@@H](C)[C@]2(O)C(=O)COC(C)=O |
|
| MCULE-6561827943 |
0.65 |
C1=CC2C(CC(C)C2OC(=O)C)C2C1C(C)C(O)CC1CC(O)=C(C(=O)O1)C2 |
|
| MCULE-3731139584 |
0.65 |
[C@@H]1(OC(=O)C)C(=O)[C@]2(C)[C@@]3([H])C(=O)C(OC)=C(C)[C@]4([H])CC(=O)O[C@@]([H])([C@]34C)C[C@@]2([H])[C@H](C)C1 |
|
| MCULE-7818387200 |
0.65 |
C1(=O)OC(C2C3CCC(C(OCC)=O)(C=C3)C12)=O |
|
| MCULE-8731331751 |
0.65 |
C([C@@]12[C@H]([C@H](O)[C@]3([H])[C@]4(CC(=O)C(O)=C(C)[C@]4([H])C[C@@]4([H])OC(=O)[C@H](OC(=O)CC(C)C)[C@]1([H])[C@@]34CO2)C)O)(=O)OC |
|
| MCULE-1935435552 |
0.65 |
O=C1C2(C3CC(C4(C(CCC4C4C5OC(=O)C(O)(C)C(C)(C5)C4)C3C3OC3C2(CC=C1)O)C)=O)C |
|
| MCULE-1022445986 |
0.65 |
C1CC2(C)C3CCC4/C(/C(CC4(C)C3(C)C(C(O)C2C(C1=O)C)=O)OC(=O)C)=C(/C(=O)O)\CC/C=C(\C)/C |
|
| MolPort-011-276-667 |
0.65 |
COc1ccc(\C=C(/C(O)=O)c2ccccc2)cc1OC |
|
| MCULE-1501922749 |
0.65 |
[C@@]12(C)[C@H](O)C[C@H](O)[C@@]1([H])C(C)C[C@@H]1OC(=O)C(=C)[C@H]1C2O |
|
| MolPort-005-310-347 |
0.65 |
COC(=O)\C=C\c1ccc(OC)c(OC)c1OC |
|
| MCULE-7503427022 |
0.65 |
C1(CC=CCC1C(=O)OCC1OC1)C(=O)OCC1OC1 |
|
| MolPort-000-669-524 |
0.65 |
CCOc1ccc(\C=C\C(=O)Oc2ccccc2)cc1OCC |
|
| MCULE-3192041589 |
0.65 |
[C@]12(C)CC(=O)[C@]3([C@@]([H])(CCC4=CC(=O)C=C[C@]34C)[C@]1([H])CC[C@]2(O)C(=O)COC(CC)=O)[H] |
|
| MolPort-035-807-964 |
0.65 |
COc1ccc(\C=C\C(O)=O)cc1OCc1cccc2ccccc12 |
|
| MCULE-2061017881 |
0.65 |
C1(C(O)=O)=C(C)C(OC21CCC(CC2)C(C)(C)C)=O |
|
| MolPort-001-823-386 |
0.65 |
COc1cc(\C=C(\C#N)C(O)=O)cc(OC)c1OC |
|
| MCULE-9705119087 |
0.65 |
[H][C@@]12CCC(C)=CCCC(C)=C[C@@]1([H])OC(=O)C2 |
|
| MolPort-000-676-225 |
0.65 |
COc1cc(\C=C\C(O)=O)cc(Br)c1OC |
|
| MCULE-3702699592 |
0.65 |
C1CC2(C)C(/C=C/C(=O)O)C(O)(C)C(O)C(OC(C)=O)C2C(C)(C)C1 |
|
| MolPort-004-037-570 |
0.65 |
OC(=O)\C=C\c1ccc2OCCCOc2c1 |
|
| MCULE-2460567264 |
0.65 |
C1(C(O)=O)=C(C)C(OC21CCC(CC2)CCCC)=O |
|
| MolPort-002-749-744 |
0.65 |
COC(=O)\C=C\c1ccc2OCCOc2c1 |
|
| MCULE-3998592213 |
0.65 |
C123CCC(O)C(C(=O)O1)(C)C2([H])C(C12CC(C(C1)(O)CCC23[H])=C)C(=O)O |
|
| MolPort-044-227-511 |
0.65 |
COc1cc(C=CC(=O)OCc2ccc(COC(=O)C=Cc3ccc(O)c(OC)c3)cc2)ccc1O |
|
| MCULE-1876484367 |
0.65 |
C1(=O)C[C@]2(C)[C@@]3([H])[C@@H](O)[C@H](O)[C@]4(OC[C@@]53[C@@]4([H])[C@@H](OC(/C=C(/C)\C)=O)C(=O)O[C@]5([H])C[C@@]2([H])C(C)=C1)C(=O)OC |
|
| MolPort-002-329-021 |
0.65 |
CCOc1cc(\C=C\C(O)=O)ccc1OCc1ccc2ccccc2c1 |
|
| MCULE-6797419887 |
0.65 |
C12(CCC3(C)CC4C(O)(C)CC(=O)C4C(C=O)=CCC13)C(C)CC(/C=C(\C)/C)O2 |
|
| MolPort-001-018-656 |
0.65 |
COc1cc(\C=C(/C#N)C(O)=O)cc(OC)c1OC |
|
| MCULE-2182894320 |
0.65 |
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 |
|
| MolPort-000-885-553 |
0.65 |
COc1cc(Br)c(\C=C\C(O)=O)cc1OC |
|
| MCULE-9817372120 |
0.65 |
O=C1CCC2(C)C3CCC4(C)C(CCC4C3CC(C2=C1)OC(C)=O)=O |
|
| MolPort-009-674-579 |
0.65 |
COC(=O)C=Cc1ccc2OCCOc2c1 |
|
| MCULE-1580462179 |
0.65 |
C1C[C@@]2([C@]3(COC(C)=O)[C@@H](OC(C)=O)C[C@@H](C)[C@](C)(CC(OC(=O)/C(/C)=C/C)C4=CC(=O)OC4)[C@@]3([H])C1OC(C(C)CC)=O)CO2 |
|
| MolPort-002-046-432 |
0.65 |
COc1ccc(\C=C\C(=O)Oc2ccc(C)c(C)c2)cc1OC |
|
| MCULE-7792538419 |
0.65 |
CC=C(C(=O)O[C@@H]1[C@]2([C@@H](C(=C[C@]3([C@@]4(C(C)(C)[C@@]4(C[C@@H](C)[C@]2(C3=O)C=C1C)[H])[H])[H])COC(=O)C)O)O)C |
|
| MolPort-003-780-568 |
0.65 |
CCOc1cc(C=CC(O)=O)cc(Cl)c1O |
|
| MCULE-9824682578 |
0.65 |
[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 |
|
| MolPort-003-922-610 |
0.65 |
COc1ccc(\C=C(/C)C=O)cc1 |
|
| MCULE-6136215019 |
0.65 |
C1=CC2CC1C(C(=O)OC)C2C(=O)OC |
|
| MolPort-002-046-409 |
0.65 |
COc1ccc(\C=C\C(=O)Oc2cc(C)cc(C)c2)cc1OC |
|
| MCULE-2528413632 |
0.65 |
CC1C(C=CC(C)=O)=CCC2C(C(OC2C1)=O)=C |
|
| MolPort-008-154-514 |
0.65 |
Oc1cccc(\C=C\c2ccccc2)c1 |
|
| MCULE-6067558194 |
0.65 |
[C@]12(C)CC[C@]3([C@@]([H])(CCC4=CC(=O)CC[C@]34C)[C@]1([H])CC[C@@H]2C(=O)COC(CCC(O)=O)=O)[H] |
|
| MolPort-011-018-587 |
0.65 |
OC(=O)C=Cc1ccc(Br)cc1 |
|
| MCULE-8982382729 |
0.65 |
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] |
|
| MolPort-038-087-871 |
0.65 |
COc1ccc(\C=C(\C)C=O)cc1 |
|
| MCULE-6266062726 |
0.65 |
C1=CC2CC1C13OC12C1CC3C=C1C(OC)=O |
|
| MolPort-003-921-372 |
0.65 |
CC(C)OC(=O)\C=C\c1ccccc1 |
|
| MCULE-4827454681 |
0.65 |
O=C1CCC2(C)C3CCC4(C)C(CCC4C3CC(C2=C1)OC(C)=O)C(C)=O |
|
| MolPort-000-145-978 |
0.65 |
OC(=O)\C=C\c1ccc(Br)cc1 |
|
| MCULE-7045262498 |
0.65 |
C1CC=C[C@]2([H])C[C@H](O)C[C@@]2([H])[C@H](O)C=CC(=O)O[C@@H](C)C1 |
|
| MolPort-023-314-157 |
0.65 |
COc1ccc(C=C(C)C=O)cc1 |
|
| MCULE-8302542414 |
0.65 |
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] |
|
| MolPort-044-614-954 |
0.65 |
COC(=O)\C=C\c1ccc(OCCBr)cc1 |
|
| MCULE-4138416849 |
0.65 |
C(C)(=O)OC1CCC2(C)C(O)(C1)CC=C1C3CCC(C(C)C=CC(C)C(C)C)C3(C)CC(C21)=O |
|
| MolPort-019-904-151 |
0.65 |
COC(=O)C=Cc1ccc(C)cc1 |
|
| MCULE-5137269050 |
0.65 |
C1(C(O)=O)C2(OCC)CCC(C=C2)(OCC)C1C(O)=O |
|
| MolPort-022-369-878 |
0.65 |
OC(=O)C(\O)=C\c1ccccc1 |
|
| MCULE-7064805050 |
0.65 |
C1(C(O)=O)=C(C)C(OC21CCC(CC2)CCC)=O |
|
| MolPort-035-807-964 |
0.65 |
COc1ccc(\C=C\C(O)=O)cc1OCc1cccc2ccccc12 |
|
| MCULE-1216188840 |
0.65 |
C(C)(=O)OC1CCC2(C)C3CCC4(C)C(C(C)CCCC(C)C)CCC4C3CC(C2=C1)=O |
|
| MolPort-044-227-511 |
0.65 |
COc1cc(C=CC(=O)OCc2ccc(COC(=O)C=Cc3ccc(O)c(OC)c3)cc2)ccc1O |
|
| MCULE-3648597514 |
0.65 |
C1(C(O)=O)=C(C)C(OC21CCC(CC2)C)=O |
|
| MolPort-023-314-157 |
0.65 |
COc1ccc(C=C(C)C=O)cc1 |
|
| MCULE-2873851707 |
0.65 |
OC(C1(CC=CC1)CC1OCCCC1)=O |
|
| MolPort-038-087-871 |
0.65 |
COc1ccc(\C=C(\C)C=O)cc1 |
|
| MCULE-7829335047 |
0.65 |
C12OC(CC1)C=C2C(OCC)=O |
|
| MolPort-000-678-784 |
0.65 |
COc1ccc(\C=C(\C(O)=O)c2ccccc2)cc1OC |
|
| MCULE-8909512492 |
0.65 |
[C@]12(C)CC([C@]3([H])[C@@]4(C)C=CC(=O)C=C4CC[C@@]3([H])[C@]1([H])CC[C@]2(O)C(=O)COC(=O)C)=O |
|
| MolPort-002-469-313 |
0.65 |
COc1ccc(C)cc1\C=C\C(O)=O |
|
| MCULE-6218547779 |
0.65 |
C12=CC[C@]3([C@@]([H])(CC[C@]3(O)C(=O)COC(C)=O)[C@]1([H])CCC1=CC(=O)C=C[C@]21C)C |
|
| MolPort-022-369-878 |
0.65 |
OC(=O)C(\O)=C\c1ccccc1 |
|
| MCULE-3659807532 |
0.65 |
C12(C([H])(C3([H])CCC4=CC(=O)C=CC4(C)C3([H])C(=O)C1)CCC2(O)C(=O)COC(C)=O)C |
|
| MolPort-000-427-362 |
0.65 |
COc1ccc(\C=C\C(=O)Oc2cccc(C)c2)cc1 |
|
| MCULE-7212452003 |
0.65 |
C1C(C)C2=C(C(OCC)=O)C(=O)CC2([H])C1 |
|
| MolPort-003-665-147 |
0.65 |
COC(=O)\C=C\c1ccc(C)cc1 |
|
| MCULE-5558502153 |
0.65 |
C1CC(C(=O)OCC2C(=C)C2)=CCC1 |
|
| MolPort-005-982-142 |
0.65 |
OC(=O)\C=C\c1ccc(OCc2cccc3ccccc23)cc1 |
|
| MCULE-7247024759 |
0.65 |
C(C)(=O)OC1CCC2(C)C3CC(C4(C)C(=CCC4C3CCC2(C1)[H])C(C)=O)=O |
|
| MolPort-044-614-954 |
0.65 |
COC(=O)\C=C\c1ccc(OCCBr)cc1 |
|
| MCULE-3044681837 |
0.65 |
CCOC(C1=CC2CCC1C=C2)=O |
|
| MolPort-000-886-399 |
0.65 |
COc1ccc(\C=C\C(O)=O)cc1Br |
|
| MCULE-8166977907 |
0.65 |
O=C(OCC1CC=CCC1)CC1CCCC1 |
|
| MolPort-000-427-361 |
0.65 |
COc1ccc(\C=C\C(=O)Oc2ccc(C)cc2)cc1 |
|
| MCULE-8149296543 |
0.65 |
C(C1OCC(O)C1O)(COC(CCCCCCCC=CCCCCCCCC)=O)(O)[H] |
|
| MolPort-002-048-929 |
0.65 |
CCOc1ccc(\C=C\C(=O)Oc2ccccc2)cc1 |
|
| MCULE-4388066404 |
0.65 |
C1[C@H](O)C[C@@]2([H])[C@H](O)C=CC(=O)O[C@@H](C)CCCC=C[C@]12[H] |
|
| MolPort-006-826-175 |
0.65 |
COc1ccc(F)c(\C=C\C(O)=O)c1 |
|
| MCULE-7140625389 |
0.65 |
C1(O)(CC2C=CC(O2)C1)C(C)C(O)=O |
|
| MolPort-002-527-637 |
0.65 |
COc1ccc(\C=C\C)cc1O |
|
| MCULE-5522120199 |
0.65 |
C1(O)(CC2C=CC(O2)C1)CC(O)=O |
|
| MolPort-000-931-476 |
0.65 |
OC(=O)\C=C\c1ccc(C=O)cc1 |
|
| MCULE-9652400026 |
0.65 |
O=C1CCC2(C)C3CCC4(C)C(O)(C(COC(C)=O)OC(C)=O)CCC4C3CCC2=C1 |
|
| MolPort-019-904-151 |
0.65 |
COC(=O)C=Cc1ccc(C)cc1 |
|
| MCULE-9513148820 |
0.65 |
O=C1C=C(CCC2OCCCC2)CCC1 |
|
| MolPort-003-905-485 |
0.65 |
COC(=O)\C=C\c1ccc(\C=C\C(=O)OC)cc1 |
|
| MolPort-028-750-499 |
0.64 |
Cc1ccc(C=CC(O)=O)c(C)c1 |
|
| MolPort-044-227-570 |
0.64 |
COc1cc(C=CC(=O)OCCOc2ccc(C)cc2)ccc1O |
|
| MolPort-028-750-496 |
0.64 |
Nc1ccc(C=CC(O)=O)cc1 |
|
| MolPort-044-227-550 |
0.64 |
COc1cc(C=CC(=O)OCCOc2ccccc2)ccc1O |
|
| MolPort-044-414-612 |
0.64 |
COc1ccc(C=CC(=O)OCCOC(=O)C=Cc2ccc(OC)cc2)cc1 |
|
| MolPort-046-595-259 |
0.64 |
COc1cc(\C=C\C(O)=O)ccc1OCc1cccc(C)c1 |
|
| MolPort-019-904-146 |
0.64 |
CCOC(=O)C=Cc1ccc(C)cc1 |
|
| MolPort-039-061-146 |
0.64 |
COc1ccc(C=CC(Cl)=O)cc1OC |
|
| MolPort-022-365-959 |
0.64 |
Oc1ccc(C=C)cc1O |
|
| MolPort-028-746-658 |
0.64 |
C=CCOC(=O)C=Cc1ccccc1 |
|
| MolPort-044-387-458 |
0.64 |
COc1cccc(C=C(C(O)=O)c2ccccc2)c1 |
|
| MolPort-039-241-392 |
0.64 |
COc1cc(C=CC(O)=O)ccc1C(F)(F)F |
|
| MolPort-044-387-264 |
0.64 |
NC(=O)COc1ccc(C=CC(O)=O)cc1 |
|
| MolPort-044-175-398 |
0.64 |
CCOC(=O)\C=C\c1ccc(O)c(F)c1 |
|
| MolPort-044-216-009 |
0.64 |
COc1ccc(C=CC(=O)OCC#N)cc1 |
|
| MolPort-027-637-541 |
0.64 |
COC(=O)\C=C\c1cccc(C)c1 |
|
| MCULE-2738564503 |
0.64 |
C1CC(C)(C)C2C(C)(C(CC/C(/COC(=O)C)=C\C(=O)O)C(C=O)=CC2O)C1 |
|
| MolPort-000-710-920 |
0.64 |
COc1cc(\C=C\C)ccc1O |
|
| MCULE-2686998361 |
0.64 |
C1C(=O)[C@]2(C)C3C(C[C@H]4O[C@]42[C@@H](O)C=1)[C@]1([H])CCC([C@H](C)C2CC(C)=C(CO)C(=O)O2)[C@@]1(C)CC3 |
|
| MolPort-028-750-496 |
0.64 |
Nc1ccc(C=CC(O)=O)cc1 |
|
| MCULE-6295390344 |
0.64 |
CC=C(C(=O)O[C@@H]1[C@]2([C@@H](C(=C[C@]3([C@@]4(C(C)(C)[C@@]4(C[C@@H](C)[C@]2(C3=O)C=C1C)[H])[H])[H])CO)O)O)C |
|
| MolPort-005-222-104 |
0.64 |
COc1ccc(C=CC(O)=O)cc1F |
|
| MCULE-7796629536 |
0.64 |
C1C[C@]2(C)[C@]34O[C@H]3[C@@H]3O[C@]3(C(C)C)C(=O)[C@]34O[C@H]3C[C@@]2([H])C2COC(=O)C1=2 |
|
| MolPort-019-707-114 |
0.64 |
CCCCCOc1ccc(\C=C\C([O-])=O)cc1 |
|
| MCULE-9035965650 |
0.64 |
C1(C=CCCCCCCCC)CCCCCCC(=O)O1 |
|