| MCULE-5475851336 |
1 |
O=C(O)[C@@]12C3C(=C(C(=CC=3CC[C@@]1([H])C(C)(C)CCC2)C(C)C)O)O
|
|
| MCULE-5689087287 |
1 |
C1(O)C(O)=C2[C@@]3(C(O)=O)CCCC(C)(C)[C@]3([H])CCC2=CC=1C(C)C
|
|
| MolPort-005-943-409 |
1 |
CC(C)C1=C(O)C(O)=C2C(CC[C@H]3C(C)(C)CCC[C@]23C(O)=O)=C1
|
|
| MolPort-046-701-759 |
1 |
CC(C)C1=CC2=C(C(O)=C1O)C1(CCCC(C)(C)C1CC2)C(O)=O
|
|
| MolPort-001-740-834 |
0.88 |
COC1=C(C=C2CCC3C(C)(C)CCC[C@]3(C(O)=O)C2=C1O)C(C)C
|
|
| MolPort-046-158-430 |
0.88 |
COC1=C(O)C2=C(CC[C@H]3C(C)(C)CCC[C@]23C(O)=O)C=C1C(C)C
|
|
| MolPort-029-674-820 |
0.86 |
OC(=O)C1CCCC2=C1C=CC=C2O
|
|
| MCULE-3110179120 |
0.86 |
OC(C1C2=C(C(=CC=C2)O)CCC1)=O
|
|
| MolPort-039-101-197 |
0.83 |
CC(C)C1=CC2=C(C=C1O)[C@]1(CCCC(C)(C)C1CC2)C=O
|
|
| MCULE-2730971863 |
0.82 |
C1C[C@]2(C=O)C3C=C(O)C(C(C)C)=CC=3CCC2C(C)(C)C1
|
|
| MolPort-022-377-731 |
0.81 |
OC(=O)C1CCCC2=C1C=CC(O)=C2
|
|
| MCULE-5843879749 |
0.81 |
OC(C1C2=C(C=C(C=C2)O)CCC1)=O
|
|
| MCULE-8090583332 |
0.77 |
C1C[C@]2(C)C3C=CC(O)=C(C(C)C)C=3CC[C@@]2([H])[C@@](C)(C(O)=O)C1
|
|
| MolPort-039-141-829 |
0.77 |
CC(C)C1=C2CC[C@H]3[C@](C)(CCC[C@]3(C)C2=CC=C1O)C(O)=O
|
|
| MolPort-008-514-731 |
0.76 |
COC1=CC2=C(CCCC2C(O)=O)C=C1
|
|
| MCULE-8249850829 |
0.76 |
COC1=CC2=C(CCCC2C(O)=O)C=C1
|
|
| MCULE-9251611973 |
0.76 |
C12CCC3C=C(C=CC=3C1C(O)CC1(C)C(CCC21)=O)O
|
|
| MCULE-5585520867 |
0.76 |
[C@@]12(C)C(=O)CC[C@@]1([H])C1([C@@]([H])(C3C=CC(=CC=3CC1)O)[C@@H](O)C2)[H]
|
|
| MolPort-007-559-787 |
0.76 |
C[C@]12C[C@H](O)[C@H]3C(CCC4=C3C=CC(O)=C4)[C@@H]1CCC2=O
|
|
| MolPort-035-757-065 |
0.76 |
C[C@]12C[C@@H](O)[C@H]3C(CCC4=C3C=CC(O)=C4)[C@@H]1CCC2=O
|
|
| MCULE-2481498287 |
0.75 |
COC(C1C2=C(C=C(C=C2)O)CCC1)=O
|
|
| MolPort-019-936-888 |
0.75 |
CC(C)C1=CC2=C(C=C1O)C1(C)CCCC(C)(C)C1C(O)C2
|
|
| MolPort-029-672-487 |
0.75 |
OC(=O)C1CCC2=C1C(O)=CC=C2
|
|
| MolPort-037-998-567 |
0.75 |
COC(=O)C1CCCC2=C1C=CC(O)=C2
|
|
| MCULE-2974487917 |
0.74 |
COC1=CC2=C(C(C(O)=O)CCC2)C=C1
|
|
| MolPort-014-559-205 |
0.74 |
COC1=CC2=C(C=C1)C(CCC2)C(O)=O
|
|
| MCULE-9446646293 |
0.72 |
[C@]1(C)(C(O)=O)[C@@]2([H])[C@@](C)(C3=C(CC2)C=CC(O)=C3)CCC1
|
|
| MCULE-4546853723 |
0.72 |
C12CC[C@]3(C(CCC3=O)[C@]1([H])CCC1C(=CC=C(O)C2=1)C)C
|
|
| MCULE-7977772608 |
0.72 |
C1C[C@]2(C)C3C=CC(O)=CC=3CC[C@@]2([H])[C@@](C(=O)O)(C)C1
|
|
| MCULE-8369774775 |
0.72 |
C12(C)CCCC(C)(C(O)=O)C1([H])CCC1C=CC(O)=CC2=1
|
|
| MolPort-039-338-879 |
0.72 |
CC(C)C1=CC2=C(C=C1O)[C@@]1(C)CCCC(C)(C)[C@@H]1[C@@H](O)C2=O
|
|
| MolPort-001-742-608 |
0.72 |
C[C@@]1(CCC[C@@]2(C)[C@H]1CCC1=C2C=C(O)C=C1)C(O)=O
|
|
| MolPort-002-800-378 |
0.72 |
CC1(CCCC2(C)C1CCC1=C2C=C(O)C=C1)C([O-])=O
|
|
| MolPort-002-509-301 |
0.72 |
CC1=CC=C(O)C2=C1CC[C@H]1C3CCC(=O)[C@@]3(C)CCC21
|
|
| MolPort-039-338-378 |
0.72 |
C[C@]1(CCC[C@@]2(C)[C@H]1CCC1=C2C=CC(O)=C1)C(O)=O
|
|
| MolPort-035-705-815 |
0.71 |
CC(C)C1=CC2=C(C=C1O)[C@@]1(C)CC[C@H](O)C(C)(C)[C@@H]1CC2
|
|
| MCULE-4625960564 |
0.71 |
C1C=C2CC(C(C(C)(C)C(=O)O)CC)CCC2=CC=1O
|
|
| MCULE-9255159027 |
0.71 |
C1C(O)=C2C(=O)C[C@@](O)(C)[C@H](C(C)=O)C2=CC=1O
|
|
| MCULE-4249997598 |
0.71 |
C1C(O)=C2C(=O)C[C@@](C)(O)[C@H](C(C)=O)C2=CC=1O
|
|
| MolPort-039-141-765 |
0.71 |
CC(=O)[C@@H]1C2=C(C(=O)C[C@@]1(C)O)C(O)=CC(O)=C2
|
|
| MolPort-039-141-764 |
0.71 |
CC(=O)[C@@H]1C2=C(C(=O)C[C@]1(C)O)C(O)=CC(O)=C2
|
|
| MolPort-046-690-033 |
0.70 |
[2H]C1=C([2H])C2=C(CC[C@H]3[C@@H]4CC([2H])([2H])C(=O)[C@@]4(C)CC[C@H]23)C(O)=C1O
|
|
| MolPort-003-941-687 |
0.70 |
C[C@]12CC[C@H]3[C@@H](CCC4=C3C=CC(O)=C4O)[C@@H]1CCC2=O
|
|
| MCULE-8916620297 |
0.70 |
[C@@]123CCCC(C)(C)[C@]1([H])C[C@H](OC2=O)C1C=C(C(O)=C(O)C3=1)C(C)C
|
|
| MCULE-8929994145 |
0.70 |
C1CC23C(=O)OC(C4=C2C(O)=C(O)C(C(C)C)=C4)CC3C(C)(C)C1
|
|
| MCULE-8524083865 |
0.70 |
O=C1[C@]23C4=C(C=C(C(C)C)C(O)=C4O)[C@](C[C@]2(C(C)(C)CCC3)[H])([H])O1
|
|
| MCULE-6133390132 |
0.70 |
C1C[C@]23C(=O)O[C@H](C4C=C(C(C)C)C(O)=C(O)C=42)C[C@@]3([H])C(C)(C)C1
|
|
| MolPort-046-593-352 |
0.70 |
CC(C)C1=C(O)C(O)=C2C(=C1)[C@H]1C[C@H]3C(C)(C)CCC[C@@]23C(=O)O1
|
|
| MolPort-001-741-284 |
0.70 |
CC(C)C1=C(O)C(O)=C2C(=C1)C1CC3C(C)(C)CCCC23C(=O)O1
|
|
| MolPort-016-580-725 |
0.70 |
CC(C)C1=CC2=C(C(O)=C1O)[C@@]13CCCC(C)(C)[C@@H]1C[C@@H]2OC3=O
|
|
| MolPort-046-792-954 |
0.69 |
C[C@]12CC[C@@H]3[C@@H](CCC4=C3C=CC(O)=C4O)[C@H]1CC[C@@H]2O
|
|
| MolPort-046-690-031 |
0.69 |
C[C@]12CC[C@H]3[C@@H](CCC4=C3C=CC(O)=C4O)[C@@H]1CC[C@@H]2O
|
|
| MCULE-3956852366 |
0.69 |
[H][C@]12C(C)(C)CCC[C@@]31C1C([C@H](O)[C@H]2OC3=O)=CC(C(C)C)=C(O)C=1O
|
|
| MCULE-2748521288 |
0.69 |
C1(C2CCCCC2)=CC(C2CCCCC2)=C(C=C1C1CCCCC1)O
|
|
| MolPort-020-005-990 |
0.69 |
CC(C)C1=C(O)C(O)=C2C(=C1)[C@H](O)[C@H]1OC(=O)[C@@]22CCCC(C)(C)[C@H]12
|
|
| MolPort-001-740-959 |
0.69 |
CC(C)C1=C(O)C(O)=C2C(=C1)C(O)[C@H]1OC(=O)[C@@]22CCCC(C)(C)C12
|
|
| MolPort-003-009-893 |
0.69 |
OC1=CC(C2CCCCC2)=C(C=C1C1CCCCC1)C1CCCCC1
|
|
| MolPort-013-430-508 |
0.69 |
CCC1(CCCC2=C1C=CC=C2)C(O)=O
|
|
| MolPort-035-705-947 |
0.69 |
CC(C)C1=C(O)C=CC2=C1CC[C@H]1C(C)(C)[C@@H](O)CC[C@]21C
|
|
| MolPort-044-723-239 |
0.69 |
CC1=CC2=C(C=C1O)[C@@]1(C)CC[C@H](O)C(C)(C)[C@@H]1CC2
|
|
| MolPort-046-766-131 |
0.69 |
C[C@]12CC[C@H]3[C@@H](CCC4=C3C=CC(O)=C4)[C@@H]1CC(=O)[C@@H]2O
|
|
| MolPort-046-766-070 |
0.69 |
[2H]C1=CC2=C(C([2H])=C1O)C([2H])([2H])C[C@H]1[C@@H]3CC(=O)[C@H](O)[C@@]3(C)CC[C@]21[2H]
|
|
| MolPort-044-561-252 |
0.69 |
C[C@]12CC[C@H]3[C@@H](CCC4=CC(O)=CC=C34)[C@@H]1C[C@@H](O)C2=O
|
|
| MolPort-003-804-191 |
0.68 |
CC(C)C1=CC2=C(C(O)=C1O)[C@@]1(C)CCCC(C)(C)[C@@H]1CC2=O
|
|
| MolPort-044-727-636 |
0.68 |
C[C@H]1CCCCCC(=O)C2=C(O)C=C(O)C=C2CC(=O)O1
|
|
| MolPort-001-739-726 |
0.68 |
CC1CCCCCC(=O)C2=C(O)C=C(O)C=C2CC(=O)O1
|
|
| MolPort-039-338-056 |
0.68 |
CCCCCCCC(=O)C1=C(CC(=O)OCC)C=C(O)C=C1O
|
|
| MCULE-8418521945 |
0.68 |
CC1([C@@H]2CC(C3=C([C@@]2(C)CCC1)C(O)=C(O)C(C(C)C)=C3)=O)C
|
|
| MCULE-5907885217 |
0.68 |
[C@@]12(CCCC(C)(C)[C@]1([H])CCC1=CC(=C(OC(C)=O)C(OC(C)=O)=C21)C(C)C)C(OC)=O
|
|
| MCULE-9128498628 |
0.68 |
C1C(O)=C2C(CC(=O)OC(C)CCCCCC2=O)=CC=1O
|
|
| MCULE-1004016519 |
0.68 |
C12(C)CCC[C@@](C)(C(=O)OC)C1CCC1C=CC(O)=CC2=1
|
|
| MCULE-6282924936 |
0.68 |
O=C(CC1C(C(=O)CCCCCCC)=C(O)C=C(O)C=1)OCC
|
|
| MCULE-7950022499 |
0.68 |
OC(C1C2=C(C=CC=C2)C2CC1C2)=O
|
|
| MCULE-6605163062 |
0.68 |
COC1=C(OC)C=C(C2(C(O)=O)CCCCC2)C=C1
|
|
| MCULE-7636505586 |
0.68 |
C123CCC4[C@](C)(CCC[C@]4(C)C(OC)=O)C1CC(C1C(=CC=C(OC)C2=1)OC)C(C(C)C)C3O
|
|
| MCULE-4769799002 |
0.68 |
OC(C1C2=C(C=CC=C2)CCC1)=O
|
|
| MCULE-1087218229 |
0.68 |
[C@@H]1(C(O)=O)C2=C(C=CC=C2)CCC1
|
|
| MCULE-5534404492 |
0.68 |
CC1(C(O)=O)C2=C(C=CC=C2)CCC1
|
|
| MCULE-5988824023 |
0.68 |
CC1(C2=C(C=CC=C2)C(C(O)=O)CC1)C
|
|
| MCULE-1750687881 |
0.68 |
C1=C2C([C@]3(C)[C@@]([H])(CC2)C(C)(C)CCC3)=CC(O)=C1C(C)C
|
|
| MCULE-4783214142 |
0.68 |
OC([C@@H]1C2=C(C=CC=C2)CCC1)=O
|
|
| MCULE-4562043261 |
0.68 |
C1C=C2[C@H](C(=O)O)CCCC2=CC=1
|
|
| MCULE-4855504979 |
0.68 |
C12C=CC=CC=1C(C(=O)O)CCC2C(=O)O
|
|
| MCULE-2088979715 |
0.68 |
OC([C@H]1C2=C(C=CC=C2)CCC1)=O
|
|
| MolPort-046-766-468 |
0.68 |
OC(=O)C1C2CC(C2)C2=CC=CC=C12
|
|
| MolPort-014-559-208 |
0.68 |
OC(=O)C1CCCCC2=C1C=CC=C2
|
|
| MolPort-004-290-546 |
0.68 |
COC1=C(OC)C=C(C=C1)C1(CCCCC1)C(O)=O
|
|
| MolPort-002-515-680 |
0.68 |
COC(=O)[C@@]1(C)CCC[C@@]2(C)C1CCC13C(O)C(C(C)C)C(CC21)C1=C3C(OC)=CC=C1OC
|
|
| MolPort-001-740-852 |
0.67 |
CC(C)C1=C(O)C=C2C(CC[C@H]3C(C)(C)CCC[C@]23C)=C1
|
|
| MolPort-035-706-209 |
0.67 |
CC(C)[C@@H]1[C@H](O)C[C@@H](C)C2=C1C=C(C)C(O)=C2
|
|
| MolPort-001-572-843 |
0.67 |
OC(=O)C1CCCC2=C1C=CC=C2
|
|
| MolPort-022-194-888 |
0.67 |
OC(=O)C1(CCCCC1)C1=CC=C(O)C=C1
|
|
| MolPort-003-987-318 |
0.67 |
OC(=O)[C@H]1CCCC2=C1C=CC=C2
|
|
| MolPort-008-650-367 |
0.67 |
CC1(C)CCC(C(O)=O)C2=C1C=CC=C2
|
|
| MolPort-003-983-916 |
0.67 |
OC(=O)[C@@H]1CCCC2=C1C=CC=C2
|
|
| MolPort-009-357-900 |
0.67 |
CC1(CCCC2=CC=CC=C12)C(O)=O
|
|
| MolPort-019-936-853 |
0.67 |
CC(C)C1=CC2=C(C(O)=C1O)[C@@]13CCCC(C)(C)[C@@H]1[C@H](OC3=O)C2=O
|
|
| MolPort-046-765-786 |
0.67 |
O[C@H](CCC(O)=O)CC1=CC(O)=C(O)C=C1
|
|
| MolPort-007-559-789 |
0.67 |
CC(=O)OC1CC2(C)C(CCC2=O)C2CCC3=C(C=CC(O)=C3)C12
|
|
| MCULE-6464967141 |
0.67 |
O=C(CC1C(C(=O)CCCCCCCC)=C(O)C=C(O)C=1)OCCCCC
|
|
| MCULE-6816748251 |
0.67 |
C1C[C@]23C(=O)O[C@H](C(=O)C4C=C(C(C)C)C(O)=C(O)C=42)[C@@]3([H])C(C)(C)C1
|
|
| MCULE-7726007778 |
0.67 |
C12(C)C(=O)CCC1([H])C1(C([H])(C3C=CC(=CC=3CC1)O)C(OC(C)=O)C2)[H]
|
|
| MolPort-002-472-213 |
0.66 |
COC1=C(C)C=CC(=C1)C1(CCCC1)C(O)=O
|
|
| MolPort-006-668-615 |
0.66 |
OC(CCC(=O)CCC1=CC=C(O)C(O)=C1)CC1=CC(O)=C(O)C=C1
|
|
| MCULE-2323717260 |
0.66 |
COC1=C(C)C=CC(C2(C(O)=O)CCCC2)=C1
|
|
| MCULE-8097976673 |
0.66 |
C1(O)C=C(CC(O)CCC(=O)CCC2C=C(O)C(O)=CC=2)C=CC=1O
|
|
| MCULE-8371919168 |
0.66 |
COC1=CC2=C(CCC2C(O)=O)C=C1
|
|
| MCULE-6785560665 |
0.66 |
C12=CC(OC)=C(C=C1CCC2C(O)=O)OC
|
|
| MolPort-019-936-838 |
0.66 |
CC(C)C1=C(O)C=C2C(=C1)C(=O)C[C@H]1C(C)(C)CCC[C@]21C
|
|
| MolPort-008-647-365 |
0.66 |
COC1=CC2=C(CCC2C(O)=O)C=C1
|
|
| MolPort-008-658-068 |
0.66 |
COC1=CC2=C(C=C1OC)C(CC2)C(O)=O
|
|
| MolPort-003-803-452 |
0.66 |
COC1=C(C)C2=C(CC[C@@H](C2)C(C)C(O)=O)C(C)=C1
|
|
| MolPort-046-690-453 |
0.65 |
CC1=C(O)C=CC2=C1CC[C@H]1[C@@H]3CC[C@H](O)[C@@]3(C)CC[C@H]21
|
|
| MolPort-046-766-098 |
0.65 |
CC1=C(O)C=CC2=C1CC[C@H]1[C@@H]3CC[C@@H](O)[C@@]3(C)CC[C@H]21
|
|
| MolPort-004-964-485 |
0.65 |
C[C@]12CC[C@H]3[C@@H](CCC4=C3C=C(O)C(O)=C4)[C@@H]1CCC2=O
|
|
| MolPort-046-690-032 |
0.65 |
[2H]C1=C2CC[C@H]3[C@@H]4CC([2H])([2H])C(=O)[C@@]4(C)CC[C@@H]3C2=C([2H])C(O)=C1O
|
|
| MolPort-002-513-854 |
0.65 |
COC1=C(OC)C=C(C(CO)=C1)C1(CCCC1)C([O-])=O
|
|
| MolPort-023-048-104 |
0.65 |
COC1=CC=CC2=C1C(CC2)C(O)=O
|
|
| MolPort-021-804-659 |
0.65 |
COC(=O)C1(C)CCC(=O)C2(C)C1C(OC(C)=O)C(O)C1=C2C(O)=CC(=C1)C(C)C
|
|
| MolPort-003-941-327 |
0.65 |
C[C@]12CC[C@H]3[C@@H](CCC4=C3C=CC(O)=C4)[C@@H]1CC[C@@H]2OC(=O)CCC1CCCC1
|
|
| MolPort-006-116-546 |
0.65 |
CCCCCCC(=O)O[C@H]1CC[C@H]2[C@@H]3CCC4=CC(O)=CC=C4[C@H]3CC[C@]12C
|
|
| MolPort-044-724-411 |
0.65 |
C[C@]12CC[C@H]3[C@@H](CCC4=CC(O)=CC=C34)[C@@H]1CCC2OC(=O)CCC1CCCC1
|
|
| MolPort-003-666-182 |
0.65 |
C[C@]12CCC3C(CCC4=C3C=CC(O)=C4)C1CC[C@@H]2OC(=O)CCC1CCCC1
|
|
| MCULE-7751960216 |
0.65 |
C(O)(=O)C(C1CCCC1)C1=CC=C(C=C1)O
|
|
| MCULE-2585612607 |
0.65 |
C1(C(CO)=CC(=C(OC)C=1)OC)C1(CCCC1)C(O)=O
|
|
| MCULE-9213319906 |
0.65 |
C(C)(C1(O)CCCC2C(OC)=CC=CC=21)=O
|
|
| MCULE-8193239539 |
0.65 |
COC1=C2C(CCC2C(O)=O)=CC=C1
|
|
| MCULE-7423352455 |
0.65 |
C1C(=O)C2(C)C3C(O)=CC(C(C)C)=CC=3C(O)C(OC(C)=O)C2C(C)(C(=O)OC)C1
|
|
| MCULE-9412344583 |
0.65 |
C1(O)=CC2=C(C=C1)[C@]1([H])[C@]([H])([C@@]3([H])[C@@](CC1)(C)[C@@H](OC(=O)CCC1CCCC1)CC3)CC2
|
|
| MCULE-3987902732 |
0.65 |
[C@@]12([H])CC[C@H](OC(=O)CCCCCC)[C@@]1(C)CC[C@]1([H])C3C=CC(O)=CC=3CC[C@@]21[H]
|
|
| MCULE-6672098100 |
0.65 |
[H][C@]12[C@@]3([H])[C@](C4C=CC(O)=CC=4CC3)([H])CC[C@]1(C)[C@@H](OC(CCCCCC)=O)CC2
|
|
| MCULE-7555922943 |
0.65 |
C12(C)CCC3(C([H])(CCC4=CC(O)=CC=C34)C1([H])CCC2OC(CCC1CCCC1)=O)[H]
|
|
| MCULE-5613759979 |
0.65 |
C1=CC2[C@@]3([H])CC[C@]4(C)[C@@H](OC(=O)CCC5CCCC5)CC[C@@]4([H])[C@]3([H])CCC=2C=C1O
|
|
| MCULE-9076905699 |
0.65 |
C1(O)C=C2C(C(=O)CC(O)CCCC(C)OC(=O)C2)=C(O)C=1
|
|
| MCULE-2221401927 |
0.65 |
C12=C(C=CC=C1CCC(=O)C2)O
|
|
| MCULE-3100157767 |
0.65 |
CC1=C(C2(C(O)=O)CCCCC2)C=CC=C1
|
|
| MCULE-3078126878 |
0.65 |
C(C1CCCCC1)(C(O)=O)C1C=CC=CC=1C
|
|
| MCULE-3230130162 |
0.65 |
[C@]12(C)CCCC(C)(C)[C@]1([H])CCC1C(C(C)C)=C(O)C=CC2=1
|
|
| MCULE-9442364561 |
0.65 |
C1(O)C=C(CC(=O)CCCCC)C(CCC(O)=O)=CC=1OC
|
|
| MCULE-8809508714 |
0.65 |
C1(CCCC1)(C(O)=O)C1=CC=C(C(OC)=C1)OC
|
|
| MCULE-8356651945 |
0.65 |
[Na+].C1(=C(CO)C=C(C(OC)=C1)OC)C1(CCCC1)C([O-])=O
|
|
| MCULE-6710301297 |
0.65 |
C1C(O)=C2C(CC(=O)OC(C)CCCC(OC)CC2=O)=CC=1O
|
|
| MolPort-005-237-014 |
0.65 |
CC1=C(C=CC=C1)C1(CCCCC1)C(O)=O
|
|
| MolPort-003-936-051 |
0.65 |
CC(C)C1=C(O)C=CC2=C1CC[C@H]1C(C)(C)CCC[C@]21C
|
|
| MolPort-008-663-190 |
0.65 |
CC1=C(C=CC=C1)C(C1CCCCC1)C(O)=O
|
|
| MolPort-001-943-692 |
0.65 |
COC1=C(OC)C=C(C=C1)C1(CCCC1)C(O)=O
|
|
| MolPort-000-718-048 |
0.65 |
[Na+].COC1=C(OC)C=C(C(CO)=C1)C1(CCCC1)C([O-])=O
|
|
| MolPort-001-739-660 |
0.65 |
COC1CCCC(C)OC(=O)CC2=CC(O)=CC(O)=C2C(=O)C1
|
|
| MolPort-005-237-045 |
0.64 |
COC1=C(C=CC=C1)C1(CCCCC1)C(O)=O
|
|
| MolPort-002-911-145 |
0.64 |
COC1=CC2=C(C=C1C)C1CCC3(C)C(CCC3=O)C1CC2
|
|
| MolPort-007-559-788 |
0.64 |
CC(=O)OC1=CC2=C(C=C1)C1C(O)CC3(C)C(CCC3=O)C1CC2
|
|
| MolPort-046-699-657 |
0.64 |
OC(=O)C12CCC(C1)C1=CC=CC=C21
|
|
| MolPort-001-742-529 |
0.64 |
C[C@]12CC[C@H]3[C@@H](CCC4=C3C=CC(O)=C4)[C@@H]1CCC2=O
|
|
| MolPort-003-073-304 |
0.64 |
COC1=C(OC)C(O)=C2CC(=O)CCCC2=C1
|
|
| MolPort-001-832-299 |
0.64 |
CC12CCC3C(CCC4=C3C=CC(O)=C4)C1CCC2=O
|
|
| MolPort-002-506-974 |
0.64 |
C[C@]12CCC3C(CCC4=C3C=CC(O)=C4)C1CCC2=O
|
|
| MolPort-006-394-004 |
0.64 |
C[C@]12CCC3[C@@H](CCC4=CC(O)=CC=C34)C1CCC2=O
|
|
| MolPort-003-934-773 |
0.64 |
[2H]C1=CC2=C(CC[C@H]3[C@@H]4CC([2H])([2H])C(=O)[C@@]4(C)CC[C@H]23)C([2H])=C1O
|
|
| MolPort-046-793-299 |
0.64 |
C[C@]12CC[C@@H]3[C@@H](CCC4=C3C=C(O)C(O)=C4)[C@H]1CC[C@@H]2O
|
|
| MolPort-000-004-264 |
0.64 |
OC(=O)C1(CCCC1)C1=CC=C(O)C=C1
|
|
| MolPort-046-689-731 |
0.64 |
[2H]C1([2H])C[C@H]2[C@@H]3CCC4=C(C=CC(O)=C4)[C@H]3CC[C@]2(C)C1=O
|
|
| MolPort-037-686-196 |
0.64 |
CC1=C(O)C(O)=CC(CCCC(O)=O)=C1C
|
|
| MolPort-039-138-933 |
0.64 |
C[C@]12CC[C@H]3[C@@H](CCC4=C3C=C(O)C(O)=C4)[C@@H]1CC[C@@H]2O
|
|
| MolPort-044-561-948 |
0.64 |
[2H]C1=C(O)C([2H])=C2CC[C@H]3[C@@H]4CCC(=O)[C@@]4(C)CC[C@@H]3C2=C1
|
|
| MolPort-044-432-209 |
0.64 |
OC(=O)C1CCCC2=C1C=CC(=C2)C#N
|
|
| MolPort-003-666-183 |
0.64 |
CCCCC(=O)O[C@H]1CCC2C3CCC4=C(C=CC(O)=C4)C3CC[C@]12C
|
|
| MolPort-046-689-727 |
0.64 |
[2H]C([2H])([2H])C([2H])([2H])C([2H])([2H])C([2H])([2H])C(=O)O[C@H]1CC[C@H]2[C@@H]3CCC4=C(C=CC(O)=C4)[C@H]3CC[C@]12C
|
|
| MolPort-002-510-737 |
0.64 |
CCCCC(=O)OC1CCC2C3CCC4=C(C=CC(O)=C4)C3CC[C@]12C
|
|
| MolPort-002-507-065 |
0.64 |
CCCCC(=O)O[C@H]1CC[C@H]2[C@@H]3CCC4=C(C=CC(O)=C4)[C@H]3CC[C@]12C
|
|
| MolPort-000-839-939 |
0.64 |
CCCCC(=O)OC1CCC2C3CCC4=C(C=CC(O)=C4)C3CCC12C
|
|
| MolPort-028-610-005 |
0.64 |
CC(C)C1=C(O)C(O)=C2C(=C1)[C@H]1OC(=O)[C@@]22CCCC(C)(C)C2[C@H]1O
|
|
| MolPort-001-740-300 |
0.64 |
CO[C@@H]1[C@H]2OC(=O)[C@@]3(CCCC(C)(C)C23)C2=C(O)C(O)=C(C=C12)C(C)C
|
|
| MolPort-046-158-428 |
0.64 |
CO[C@@H]1[C@H]2OC(=O)[C@@]3(CCCC(C)(C)[C@H]23)C2=C1C=C(C(C)C)C(O)=C2O
|
|
| MCULE-6581463668 |
0.64 |
C12CCC3C=C(C(C)=CC=3C1CCC1(C)C(CCC21)=O)OC
|
|
| MCULE-5656564030 |
0.64 |
COC1C=CC=CC=1C1(C(=O)O)CCCCC1
|
|
| MCULE-7222154732 |
0.64 |
C12(C)C(=O)CCC1([H])C1(C([H])(C3C=CC(=CC=3CC1)OC(C)=O)C(O)C2)[H]
|
|
| MCULE-3163017198 |
0.64 |
COC1=C(OC)C(O)=C2C(CCCC(C2)=O)=C1
|
|
| MCULE-7215096855 |
0.64 |
C[C@]12CC[C@@]3([H])[C@](CCC4C=C(O)C(O)=CC=43)([H])[C@]1([H])CC[C@@H]2O
|
|
| MCULE-2387689396 |
0.64 |
C1CCC(C(O)=O)(C2C=CC(O)=CC=2)C1
|
|
| MCULE-8990776504 |
0.64 |
C1(C)=C(C)C(CCCC(O)=O)=CC(O)=C1O
|
|
| MCULE-6732064308 |
0.64 |
[C@]12(C)CC[C@]3([C@@]([H])(CCC4=CC(O)=CC=C34)[C@]1([H])CC[C@@H]2OC(CCCC)=O)[H]
|
|
| MCULE-8517962855 |
0.64 |
CCCCC(=O)O[C@@H]1[C@]2(C)[C@@]([C@]3([C@@](CC2)([H])C2C=CC(=CC=2CC3)O)[H])([H])CC1
|
|
| MCULE-2633245326 |
0.64 |
C12(C)CCC3C(CCC4=CC(O)=CC=C34)C1CCC2OC(CCCC)=O
|
|
| MCULE-5539175668 |
0.64 |
C1C[C@]23C(C(C)(C)C1)[C@H](OC2=O)[C@@H](OC)C1C=C(C(C)C)C(O)=C(O)C3=1
|
|
| MCULE-3458781824 |
0.64 |
C1(C2CCCCC2)=C(O)C=C(C(C2CCCCC2)=C1)C
|
|
| MCULE-7795833425 |
0.64 |
C(O)(C(CCCCC)C1=CC=CC=C1C)=O
|
|
| MCULE-8503537561 |
0.64 |
C12C=CC(=CC=1CCC2C(O)=O)OC
|
|
| MCULE-1706073241 |
0.64 |
COC1=CC(C2(C(O)=O)CCCC2)=CC=C1
|
|
| MCULE-5872671103 |
0.64 |
C12=C(C=CC=C1CCC(C2)C(O)=O)O
|
|
| MolPort-023-313-434 |
0.64 |
OC(=O)CCCCC1=CC(O)=C(O)C=C1
|
|
| MolPort-003-724-430 |
0.64 |
CC1=C(C=C(C2CCCCC2)C(O)=C1)C1CCCCC1
|
|
| MolPort-008-647-367 |
0.64 |
COC1=CC2=C(C=C1)C(CC2)C(O)=O
|
|
| MolPort-046-690-035 |
0.64 |
C[C@]12CC[C@H]3[C@@H](CCC4=C3C=CC(O)=C4O)[C@@H]1CCC2(O)C#C
|
|
| MolPort-008-513-019 |
0.64 |
COC1=CC=CC(=C1)C1(CCCC1)C(O)=O
|
|
| MolPort-001-740-585 |
0.63 |
CC(O)CCCCCCCCCC(=O)CC1=CC(O)=CC(O)=C1
|
|
| MolPort-004-964-119 |
0.63 |
C[C@]12CC[C@H]3[C@@H](CC(=O)C4=CC(O)=CC=C34)[C@@H]1CC[C@@H]2O
|
|
| MolPort-001-739-781 |
0.63 |
CC1CCCC2OC2C(=O)C2=C(O)C=C(O)C=C2CC(=O)O1
|
|
| MolPort-046-761-772 |
0.63 |
C[C@]12CCC(=O)[C@@H](CCC3=CC(O)=CC=C3O)[C@@H]1CC[C@@H]2O
|
|
| MolPort-002-911-156 |
0.63 |
COC1=CC=C(C)C2=C1C1CCC3(C)C(CCC3=O)C1CC2
|
|
| MCULE-6155349716 |
0.63 |
C1=C(C=C(C=C1O)CC(CCCCCCCCCC(O)C)=O)O
|
|
| MCULE-6496781996 |
0.63 |
C(O)(=O)CC1(CCC)CCC2=C(C1=O)C=CC(O)=C2
|
|
| MCULE-9322153084 |
0.63 |
C1(O)C=C2C(C(=O)C3OC3CCCC(C)OC(=O)C2)=C(O)C=1
|
|
| MCULE-6893254039 |
0.63 |
C12CCC3C(C)=CC=C(OC)C=3C1CCC1(C)C(CCC21)=O
|
|
| MCULE-4462573938 |
0.63 |
C12CCC3=C(C=CC(C(C)C)=C3)C1CCCC2(C)C(O)=O
|
|
| MCULE-3231986709 |
0.63 |
C12(C)CCCC(C)(C(O)=O)C1CCC1C=C(C(C)C)C=CC2=1
|
|
| MCULE-4388835078 |
0.63 |
C12CCC3C=C(C=CC=3C1C(C)CC1(C)C(CCC21)O)O
|
|
| MCULE-4043010777 |
0.63 |
[C@]12(C)CCC[C@@](C)(C(O)=O)[C@]1([H])CCC1C=C(C(C)C)C=CC2=1
|
|
| MCULE-1304124190 |
0.63 |
[C@@]12([H])CC[C@@H](O)[C@@]1(C)CC[C@]1([H])C3C=CC(O)=CC=3CC[C@@]21[H]
|
|
| MCULE-5876999286 |
0.63 |
[C@@]1(C)(C(O)=O)[C@]2([H])[C@@](C)(C3=C(CC2)C=C(C(C)C)C=C3)CCC1
|
|
| MCULE-1095311163 |
0.63 |
C1(=CC2=C(C=C1)[C@]1([H])[C@]([H])([C@@]3([H])[C@@](CC1)(C)[C@@H](O)CC3)CC2)O
|
|
| MCULE-9777047906 |
0.63 |
C12(C)C(O)CCC1C1C(C3=CC=C(C=C3CC1)O)CC2
|
|
| MCULE-2217552374 |
0.63 |
C1C=C2[C@@]3([H])CC[C@]4(C)[C@@H](O)CC[C@@]4([H])[C@]3([H])CCC2=CC=1O
|
|
| MCULE-1951331389 |
0.63 |
C1C[C@]2(C)C3C=CC(C(C)C)=CC=3CC[C@@]2([H])[C@@](C(=O)O)(C)C1
|
|
| MCULE-8526342549 |
0.63 |
C(C1CCCC1)(C(O)=O)C1C=CC=CC=1C
|
|
| MCULE-1435791916 |
0.63 |
[C@]12(C)CCC[C@@](C)(C(O)=O)C1CCC1C=C(C(C)C)C=CC2=1
|
|
| MCULE-1811071576 |
0.63 |
[C@@]12([H])CC[C@@H](O)[C@@]1(C)CC[C@]1([H])C3C=CC(O)=CC=3CC[C@@]21[H]
|
|
| MCULE-5845361930 |
0.63 |
O=C(CC1CCC2C=C(C=CC=2C1)OC)O
|
|
| MCULE-4812881679 |
0.63 |
COC1=CC=C(C2(C(O)=O)CCCCC2)C=C1
|
|
| MCULE-4527671737 |
0.63 |
COC1=CC=C(C(C(O)=O)C2CCCCC2)C=C1
|
|
| MCULE-5192490745 |
0.63 |
C12C=C(O)C=CC=1CCC(=O)C2
|
|
| MCULE-5768810188 |
0.63 |
C1(C(=C2C(=CC=1O)CC(O)CC2=O)C)C(=O)C
|
|
| MCULE-7965627203 |
0.63 |
C12C(OC)=CC(OC)=CC=1CC(=O)C1CCCCC21
|
|
| MolPort-002-911-125 |
0.63 |
CC1CC2(C)C(O)CCC2C2CCC3=C(C=CC(O)=C3)C12
|
|
| MolPort-001-740-064 |
0.63 |
C[C@]12CCC3[C@@H](CCC4=C3C=CC(O)=C4)C1CC[C@H]2O
|
|
| MolPort-045-903-064 |
0.63 |
CC(C)C1=CC=C2C3CCCC(C)(C3CCC2=C1)C(O)=O
|
|
| MolPort-046-766-129 |
0.63 |
C[C@]12CC[C@H]3[C@H]([C@@H]1CC[C@@H]2O)C(CCCCCCCCCC1CC2=C(C=CC(O)=C2)[C@H]2CC[C@]4(C)[C@@H](O)CC[C@H]4[C@H]12)CC1=CC(O)=CC=C31
|
|
| MolPort-006-147-726 |
0.63 |
CC(C)C1=CC2=C(C=C1)[C@@]1(C)CCC[C@](C)([C@@H]1CC2)C(O)=O
|
|
| MolPort-003-847-099 |
0.63 |
[2H]C1([2H])C[C@H]2[C@@H]3CCC4=C(C=CC(O)=C4)[C@H]3CC[C@]2(C)[C@@]1([2H])O
|
|
| MolPort-001-794-632 |
0.63 |
C[C@]12CC[C@H]3[C@@H](CCC4=C3C=CC(O)=C4)[C@@H]1CC[C@@H]2O
|
|
| MolPort-003-941-281 |
0.63 |
[2H]C1=CC2=C(CC[C@H]3[C@@H]4CC[C@H](O)[C@@]4(C)CC[C@H]23)C([2H])=C1O
|
|
| MolPort-003-941-332 |
0.63 |
C[C@]12CC[C@H]3[C@@H](CCC4=CC(O)=CC=C34)[C@@H]1CC[C@H]2O
|
|
| MolPort-001-742-177 |
0.63 |
CC(C)C1=CC=C2C(CCC3C(C)(CCCC23C)C(O)=O)=C1
|
|
| MolPort-001-740-914 |
0.63 |
CC(C)C1=CC=C2C(CCC3[C@@](C)(CCC[C@]23C)C(O)=O)=C1
|
|
| MolPort-039-033-283 |
0.63 |
[2H]C1([2H])CC2=CC(=CC=C2[C@@]2(C)CCC[C@](C)(C12)C(O)=O)C(C)C
|
|
| MolPort-000-720-875 |
0.63 |
CC12CCC3C(CCC4=C3C=CC(O)=C4)C1CCC2O
|
|
| MolPort-006-122-465 |
0.63 |
CCCC(=O)O[C@H]1CC[C@H]2[C@@H]3CCC4=CC(O)=CC=C4[C@H]3CC[C@]12C
|
|
| MolPort-008-604-414 |
0.63 |
CC1=C(C=CC=C1)C(C1CCCC1)C(O)=O
|
|
| MolPort-006-318-980 |
0.63 |
C[C@]12CCC3C(CCC4=C3C=CC(O)=C4)C1CCC2O
|
|
| MolPort-023-223-770 |
0.63 |
CC(C)C1=CC=C2C(CC[C@H]3[C@](C)(CCC[C@]23C)C(O)=O)=C1
|
|
| MolPort-009-199-925 |
0.63 |
COC1=CC=C2CC(CC(O)=O)CCC2=C1
|
|
| MolPort-009-018-993 |
0.63 |
CCC1(O)CCC2[C@@H]3CCC4=CC(O)=CC=C4C3CC[C@]12C
|
|
| MolPort-008-492-175 |
0.63 |
COC1=CC=C(C=C1)C(C1CCCCC1)C(O)=O
|
|
| MolPort-002-070-514 |
0.63 |
COC1=CC=C(C=C1)C1(CCCCC1)C(O)=O
|
|
| MolPort-002-499-619 |
0.63 |
OC(=O)C1CCC2=CC=C(O)C=C2C1
|
|
| MolPort-039-338-794 |
0.63 |
COC1=C(O)C2=C(CC[C@H]3C(C)(C)CCC[C@]23C)C=C1C(C)C
|
|
| MolPort-001-739-528 |
0.63 |
CC(=O)C1=C(O)C=C2CC(O)CC(=O)C2=C1C
|
|
| MolPort-003-989-993 |
0.63 |
OC1=CC=C2CCC(=O)CC2=C1
|
|
| MolPort-046-690-736 |
0.63 |
C[C@]12CC[C@H]3[C@@H](CCC4=C3C=CC(O)=C4)[C@@H]1CC(=O)[C@@]2(O)C#C
|
|
| MolPort-004-343-147 |
0.63 |
COC1=CC2=C(C=C1)C(N)(CCC2)C(O)=O
|
|
| MolPort-007-559-791 |
0.63 |
CC(=O)OC1CC2(C)C(CCC2=O)C2CCC3=C(C=CC(O)=C3)C12O
|
|
| MolPort-035-946-521 |
0.63 |
CC(=O)O[C@H]1CC[C@H]2[C@@H]3CCC4=CC(O)=C(C=C4[C@H]3CC[C@]12C)C(C)=O
|
|
| MolPort-046-790-464 |
0.63 |
CCO[C@@H]1[C@H]2OC(=O)[C@@]3(CCCC(C)(C)[C@H]23)C2=C1C=C(C(C)C)C(O)=C2O
|
|
| MolPort-007-989-905 |
0.62 |
OC(=O)C1(CCCCC1)C1=CC2=C(OCO2)C=C1
|
|
| MolPort-028-763-717 |
0.62 |
COC(=O)C1(C)CCCC2=CC=CC=C12
|
|
| MolPort-002-525-775 |
0.62 |
OC(=O)[C@@H]1CC[C@@](C(O)=O)(C2=CC=CC=C2)C2=C1C=CC=C2
|
|
| MolPort-005-712-213 |
0.62 |
COC(=O)C1CCCC2=CC=CC=C12
|
|
| MolPort-039-338-761 |
0.62 |
CC(C)(O)C1=CC2=C(C=C1O)[C@@]1(C)CCCC(C)(C)[C@@H]1CC2
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0.62 |
COC1=CC=C2CCC(O)(C(O)=O)C2=C1
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0.62 |
C12CCC(C(C)C1O)C1C(OC)=CC=C(OC)C2=1
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0.62 |
C12(O)C3C=CC(=CC=3CCC1([H])C1(C(C)(C(CC1)=O)CC2OC(C)=O)[H])O
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|
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0.62 |
COC1=CC2CCCC(C(O)=O)(N)C=2C=C1
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0.62 |
[C@]12(C)CC[C@]3([C@@]([H])(CCC4C=C(C(C(C)=O)=CC3=4)O)[C@]1([H])CC[C@@H]2OC(C)=O)[H]
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0.62 |
C12CCC(C(C)(O)C1)C1C(OC)=CC=C(OC)C2=1
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0.62 |
C(O)(C(CCC(C)C)C1=CC=CC=C1C)=O
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OC(C1(C2=CC3=C(OCO3)C=C2)CCCCC1)=O
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0.62 |
C(O)(=O)CC1(CC)CCC2=C(C1=O)C=CC(O)=C2
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C(O)(=O)CC1(C)CCC2=C(C1=O)C=CC(O)=C2
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0.62 |
COC(C1(C2=C(C=CC=C2)CCC1)C)=O
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| MCULE-2982442388 |
0.62 |
COC(C1C2=C(C=CC=C2)CCC1)=O
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C1(O)(CCC2C=CC(OC)=CC1=2)C(O)=O
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0.62 |
C12(O)C3C=CC(=CC=3CCC1([H])C1(C(C)(C(CC1)=O)CC2=O)[H])OC(C)=O
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0.62 |
Cl.COC1=CC2CCCC(C(O)=O)(N)C=2C=C1
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0.62 |
COC1=C(C)C=CC(C2(C(O)=O)CCC2)=C1
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0.62 |
CC1=C(C2(C(O)=O)CCCC2)C=CC=C1
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C1(CC(OC)=O)C2CCC3C(=CC=C(OC)C=3)C2CCC1(C)C(OC)=O
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[2H][13C]([2H])([2H])OC1=C(O)C=CC2=C1CC[C@H]1[C@@H]3CCC(=O)[C@@]3(C)CC[C@H]21
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COC1=C(O)C=CC2=C1CC[C@H]1[C@@H]3CCC(=O)[C@@]3(C)CC[C@H]21
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COC1=CC=CC2=C1CCCC(=O)C2
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Cl.COC1=CC2=C(C=C1)C(N)(CCC2)C(O)=O
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CC(=O)OC1=CC2=C(C=C1)C1(O)C(CC2)C2CCC(=O)C2(C)CC1=O
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COC1=C(C)C=CC(=C1)C1(CCC1)C(O)=O
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CC1=C(C=CC=C1)C1(CCCC1)C(O)=O
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COC(=O)C1(CCCC1)C1=CC(OC)=C(OC)C=C1
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CCCOC1=CC(C)=C2CC[C@H](CC2=C1C)[C@H](C)C(O)=O
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C[C@]12CCC3[C@@H](CCC4=CC(O)=CC=C34)C1CC(O)[C@@H]2O
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C[C@]12CC[C@H]3C(CCC4=CC(O)=CC=C34)[C@@H]1C[C@@H](O)C2O
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C[C@]12CC[C@H]3[C@@H](CCC4=C3C=CC(O)=C4)[C@@H]1C[C@@H](O)[C@@H]2O
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C[C@]12CCC3C(CCC4=C3C=CC(O)=C4)[C@@H]1C[C@@H](O)[C@@H]2O
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C[C@]12CC[C@H]3[C@@H](CCC4=C3C=CC(O)=C4)[C@@H]1C[C@@H](O)[C@H]2O
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OC1=CC(O)=C(C=C1)C1C(=O)CCCC1=O
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C[C@]12CC[C@H]3[C@@H](CCC4=C3C=CC(O)=C4)[C@@H]1C[C@@H](O)C2O
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OC1=CC=C2CC(=O)CCC2=C1
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C[C@]12CC[C@H]3[C@@H](CCC4=C3C=CC(O)=C4)[C@@H]1C[C@H](O)[C@@H]2O
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[2H]C1([2H])[C@H]2[C@@H]3C[C@@H](O)[C@@H](O)[C@@]3(C)CC[C@]2([2H])C2=CC=C(O)C=C2C1([2H])[2H]
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CC12CCC3C(CCC4=C3C=CC(O)=C4)C1CC(O)C2O
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COC(=O)C1(C)CCC(O)C2(C)C1C(OC(C)=O)C(O)C1=C2C(O)=CC(=C1)C(C)C
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0.61 |
OC(=O)C12CCC(C3=CC=CC=C13)C1=CC=CC=C21
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0.61 |
CC(=O)O[C@H]1CC[C@H]2[C@@H]3CCC4=C(C=CC(O)=C4)[C@H]3CC[C@]12C
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0.61 |
[2H]C1([2H])C[C@H]2[C@@H]3CCC4=CC(O)=CC=C4[C@H]3CC[C@]2(C)C1([2H])OC(C)=O
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CC(=O)OC1=CC2=C(C=C1)C1(O)C(O)CC3(C)C(CCC3=O)C1CC2
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0.61 |
CC(O)[C@H]1C=C2[C@@](C)(CC[C@@]3(C)[C@@H]4C[C@@](C)(CC[C@]4(C)CC[C@]23C)C(O)=O)C2=CC(O)=C(O)C(C)=C12
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CC1=CC(=C(O)C(C)=C1CC(O)=O)C(C)(C)C
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CC(C)(C)C1=CC=C(C=C1)C1(CCCCC1)C(O)=O
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0.61 |
CC1=CC=C(C=C1)C(C1CCCCC1)C(O)=O
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CC1=CC=C(C=C1)C1(CCCCC1)C(O)=O
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CC(C)C1=CC=C(C=C1)C1(CCCCC1)C(O)=O
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COC1=CC2=C(CCCC(=O)C2)C=C1
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COC(=O)C1(C)CCC(O)C2(C)C1C(OC(C)=O)C(O)C1=C2C=C(O)C(=C1)C(C)C
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|
| MCULE-4311416051 |
0.61 |
C1(CCCC1)(C(OC)=O)C1=CC=C(C(OC)=C1)OC
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0.61 |
C1C[C@@H]([C@@H](C(O)=O)C)CC2=C(C)C(OCCC)=CC(C)=C12
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|
| MCULE-7690640656 |
0.61 |
C12C=CC(=CC=1CCC(=O)C2)O
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0.61 |
[C@]12(C)CC[C@]3([C@@]([H])(CCC4=CC(O)=CC=C34)[C@]1([H])C[C@@H](O)[C@@H]2O)[H]
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| MCULE-5981835412 |
0.61 |
C12=CC=C(C=C1CCC2C(O)=O)C(C)C
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0.61 |
C1CC(=O)C(C2=C(O)C=C(O)C=C2)C(=O)C1
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0.61 |
C1C=C2[C@@]3([H])CC[C@]4(C)[C@@H](O)[C@H](O)C[C@@]4([H])[C@]3([H])CCC2=CC=1O
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0.61 |
C12(C)CCC3C(CCC4C=C(O)C=CC3=4)C1CC(O)C2O
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C(O)(=O)CC1CC2=C(C1)C=CC=C2O
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C1C(O)C2(C)C3C(O)=CC(C(C)C)=CC=3C(O)C(OC(C)=O)C2C(C)(C(=O)OC)C1
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0.61 |
C[C@]12CC[C@]3([H])C4C=CC(O)=CC=4CC[C@@]3([H])[C@]1([H])CC[C@@H]2OC(=O)C
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0.61 |
C12(O)C(O)CC3(C([H])(CCC3=O)C1([H])CCC1C=C(OC(C)=O)C=CC2=1)C
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0.61 |
C(O)(=O)C(C1CCCCC1)C1=CC=C(C=C1)C
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0.61 |
CC(C1=CC=C(C2(C(O)=O)CCCCC2)C=C1)(C)C
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0.61 |
C1(CCCCC1)(C1=CC=C(C=C1)C)C(O)=O
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| MCULE-1337877642 |
0.61 |
CC(C1C=CC(C2(C(=O)O)CCCCC2)=CC=1)C
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0.61 |
C1(=CC=C(C(OC)=C1)OC)C(CCC)C(O)=O
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0.61 |
C(O)(=O)C(C1CCCC1)C1=CC=C(C=C1)OC
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COC1=CC(C2(C(O)=O)CCCC2)=CC(OC)=C1
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0.61 |
O(C1CCC2C1(C)CCC1C2CCC2C=C(O)C=CC=21)C(CCC1C=CC=CC=1)=O
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0.61 |
OC(CC(=O)CCC1C=CC(O)=CC=1)CCC1C=CC(O)=C(O)C=1
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0.61 |
C1(O)C=C(CCC(=O)C[C@@H](O)CCC2C=C(O)C(O)=CC=2)C=CC=1O
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0.61 |
C1(C(=O)O)(CCCC1)C1=CC=CC(OCCCC)=C1
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0.61 |
COC1=CC=C(C=C1)C1(CC2(CCC2)C1)C(O)=O
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C[C@]12CC[C@H]3[C@@H](C[C@@H](O)C4=C3C=CC(O)=C4)[C@@H]1CC[C@@H]2O
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C[C@]12CC[C@H]3[C@@H](C[C@H](O)C4=C3C=CC(O)=C4)[C@@H]1CC[C@@H]2O
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COC1=CC=C(C=C1)C(C1CCCCCC1)C(O)=O
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COC1=CC=C(C=C1)C(C1CCCC1)C(O)=O
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COC1=CC(=CC(OC)=C1)C1(CCCC1)C(O)=O
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COC1=C(O)C=CC2=C1CC[C@H]1[C@@H]3CC[C@H](O)[C@@]3(C)CC[C@H]21
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0.61 |
[2H]C([2H])([2H])OC1=C(O)C=CC2=C1CC[C@H]1[C@@H]3CC[C@H](O)[C@@]3(C)CC[C@H]21
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OC(CCC1=CC=C(O)C(O)=C1)CC(=O)CCC1=CC=C(O)C=C1
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O[C@@H](CCC1=CC=C(O)C(O)=C1)CC(=O)CCC1=CC=C(O)C(O)=C1
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CCCCOC1=CC=CC(=C1)C1(CCCC1)C(O)=O
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COC1=C(OC)C=C(C=C1)C(C1CC1)C(O)=O
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COC1=C(OC)C=C(C=C1)C1(CCC1)C(O)=O
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CCCCCCOC1=CC2=C(C=C1)[C@H]1CC[C@@]3(C)[C@@H](CCC3=O)[C@@H]1CC2
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OC(=O)C(C1CCCC1)C1=CC2=C(OCCO2)C=C1
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CC1=C(O)C=CC2=C1CC[C@H]1[C@@H]3CC[C@@](O)(C#C)[C@@]3(C)CC[C@H]21
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COC1=CC2=C(C=C1)C(CC(O)=O)CCC2
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C[C@]12CCC3C(CCC4=C3C=CC(O)=C4)C1CCC2OC(=O)CCC(O)=O
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CC(=O)OC1=CC2=C(C=C1)C1C(O)CC3(C)C(O)CCC3C1CC2
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COC1=C(C(C)C)C(O)=C(O)C2=C1C(O)C1OC(=O)C22CCCC(C)(C)C12
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C[C@]12CC[C@H]3[C@@H](CCC4=CC(O)=CC=C34)[C@@H]1[C@@H](O)[C@@H](O)[C@@H]2O
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COC(=O)[C@@]1(C)CCCC2(C)C1CCC1=C2C=CC(=C1)C(C)C
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[2H]C1=C(O)C([2H])=C2C(=C1)[C@H]1CC[C@]3(C)[C@@H](O)[C@H](O)[C@H](O)[C@H]3[C@@H]1CC2([2H])[2H]
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CC1=CC=C2C(=O)CCCC2=C1O
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OC(=O)CCCCC1=CC(O)=CC=C1
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0.60 |
COC(=O)[C@]1(C)CCC[C@@]2(C)[C@H]1CCC1=C2C=CC(=C1)C(C)C
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|
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0.60 |
C1(C=CC(=C(OC)C=1)OC)C(C(O)=O)C1CC1
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0.60 |
COC1=C(OC)C=C(C2(C(O)=O)CCC2)C=C1
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0.60 |
[C@]12(C)CC[C@]3([C@@]([H])(CCC4=CC(OCCCCCC)=CC=C34)[C@]1([H])CCC2=O)[H]
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0.60 |
C12(C)CCC3C(CCC4C=C(OCCCCCC)C=CC3=4)C1CCC2=O
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|
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0.60 |
C12CCC(C1=O)C1=C2C(OC)=CC=C1OC
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0.60 |
C1(C=CC2=C(OCCO2)C=1)C(C1CCCC1)C(O)=O
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|
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0.60 |
C12=CC=C(C=C1CCC2C(O)=O)C
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0.60 |
C1(C(C)=O)=CC2CCCCC=2C(C)=C1O
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0.60 |
C(O)(CCCCC1C(O)=C(OC)C=CC=1)=O
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|
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0.60 |
COC1=CC2=C(C(CCC2)CC(O)=O)C=C1
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0.60 |
[C@]12(C)CCC3C(CCC4=CC(O)=CC=C34)C1CCC2OC(CCC(O)=O)=O
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|
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0.60 |
C12(C)C(O)CCC1([H])C1(C([H])(C3C=CC(=CC=3CC1)OC(C)=O)C(O)C2)[H]
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0.60 |
OC(C1CCC(NC(C2C3C=CC=C(O)C=3CCC2)=O)CC1)=O
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0.60 |
C1CC23C(=O)OC(C(O)C4C(OC)=C(C(C)C)C(O)=C(O)C=42)C3C(C)(C)C1
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0.60 |
OC(CCCCC1=CC(O)=CC=C1)=O
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O=C1C2C=CC(=C(O)C=2CCC1)C
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0.60 |
O=C(OC)[C@]1([C@@]2([H])[C@](C3C=CC(C(C)C)=CC=3CC2)(C)CCC1)C
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0.60 |
C12(C)CCC[C@](C)(C(OC)=O)C1CCC1C=C(C(C)C)C=CC2=1
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0.60 |
C12=CC=C(OC)C=C1CCCC(=O)C2
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0.60 |
O=C(OC)[C@]1([C@@]2([H])[C@](C3C=CC(C(C)C)=CC=3CC2)(C)CCC1)C
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|
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0.60 |
C(OC)(=O)[C@]1(CCC[C@]2(C)C3=C(CC[C@@]12[H])C=C(C(C)C)C=C3)C
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0.60 |
C1(CC(=O)OCC)C(C(=O)CCCCCCC)=CC(OC)=C(OC)C=1OC
|
|
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0.60 |
C1C(O)C2(C)C3C(O)=CC(C(C)C)=CC=3C(O)C(OC(C)=O)C2C(C)(C(=O)OC)C1O
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|
| MCULE-8097375473 |
0.60 |
C1(CCCC1)(C1C=CC(=CC=1)OC)C(O)=O
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|
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0.60 |
C(O)(=O)C(C1=CC=CC=C1C1CCCCC1)O
|
|
| MCULE-3023274241 |
0.60 |
C1[C@@H](O)C[C@@H](C2C(O)=CC(C(C)(C)CCCCCC)=CC=2)[C@H](CCCO)C1
|
|
| MCULE-7848250635 |
0.60 |
C12C(C)(C)CC(C)(C)C=1C=C(C(O)=C2C(C)C)C(C)C
|
|
| MCULE-7970186149 |
0.60 |
C1(C=CC2=C(CCCC2)C=1)C(C(C)C)C(O)=O
|
|
| MCULE-2143498791 |
0.60 |
OC1C([C@@H]2CCC[C@H](O)C2)=CC=C(C(CCCCCC)(C)C)C=1
|
|
| MCULE-9761279694 |
0.60 |
C1(C(C)(C)C)C=C2C(C)(C)CCC2=C(CC(=O)O)C=1
|
|
