| MolPort-020-005-990 |
1 |
CC(C)c1cc2[C@H](O)[C@H]3OC(=O)[C@@]4(CCCC(C)(C)[C@H]34)c2c(O)c1O |
|
| MolPort-001-740-959 |
1 |
CC(C)c1cc2C(O)[C@H]3OC(=O)[C@@]4(CCCC(C)(C)C34)c2c(O)c1O |
|
| MCULE-3956852366 |
1 |
[H][C@]12C(C)(C)CCC[C@@]31C1C([C@H](O)[C@H]2OC3=O)=CC(C(C)C)=C(O)C=1O |
|
| MolPort-046-158-428 |
0.93 |
CO[C@@H]1[C@H]2OC(=O)[C@@]3(CCCC(C)(C)[C@H]23)c2c(O)c(O)c(cc12)C(C)C |
|
| MolPort-001-740-300 |
0.93 |
CO[C@@H]1[C@H]2OC(=O)[C@@]3(CCCC(C)(C)C23)c2c(O)c(O)c(cc12)C(C)C |
|
| MCULE-5539175668 |
0.93 |
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 |
|
| MolPort-046-790-464 |
0.91 |
CCO[C@@H]1[C@H]2OC(=O)[C@@]3(CCCC(C)(C)[C@H]23)c2c(O)c(O)c(cc12)C(C)C |
|
| MolPort-044-637-459 |
0.87 |
COc1c(C(C)C)c(O)c(O)c2c1C(O)C1OC(=O)C22CCCC(C)(C)C12 |
|
| MolPort-021-804-659 |
0.87 |
COC(=O)C1(C)CCC(=O)C2(C)C1C(OC(C)=O)C(O)c1cc(cc(O)c21)C(C)C |
|
| MCULE-3497484581 |
0.87 |
C1CC23C(=O)OC(C(O)C4C(OC)=C(C(C)C)C(O)=C(O)C=42)C3C(C)(C)C1 |
|
| MCULE-7423352455 |
0.87 |
C1C(=O)C2(C)C3C(O)=CC(C(C)C)=CC=3C(O)C(OC(C)=O)C2C(C)(C(=O)OC)C1 |
|
| MolPort-028-610-005 |
0.85 |
CC(C)c1cc2[C@H]3OC(=O)[C@@]4(CCCC(C)(C)C4[C@H]3O)c2c(O)c1O |
|
| MolPort-021-804-657 |
0.83 |
COC(=O)C1(C)CCC(O)C2(C)C1C(OC(C)=O)C(O)c1cc(cc(O)c21)C(C)C |
|
| MCULE-4462975930 |
0.83 |
C1C(O)C2(C)C3C(O)=CC(C(C)C)=CC=3C(O)C(OC(C)=O)C2C(C)(C(=O)OC)C1 |
|
| MolPort-021-804-656 |
0.82 |
COC(=O)C1(C)CCC(O)C2(C)C1C(OC(C)=O)C(O)c1cc(C(C)C)c(O)cc21 |
|
| MolPort-019-936-760 |
0.81 |
COC1[C@H]2OC(=O)[C@@]3(CCCC(C)(C)[C@H]23)c2c(O)c(O)c(C(C)C)c(OC)c12 |
|
| MolPort-021-804-654 |
0.81 |
COC(=O)C1(C)C(O)CC(O)C2(C)C1C(OC(C)=O)C(O)c1cc(cc(O)c21)C(C)C |
|
| MCULE-1353927995 |
0.81 |
C1C(O)C2(C)C3C(O)=CC(C(C)C)=CC=3C(O)C(OC(C)=O)C2C(C)(C(=O)OC)C1O |
|
| MCULE-4924847499 |
0.81 |
C1C[C@]23C(=O)O[C@H](C(OC)C4C(OC)=C(C(C)C)C(O)=C(O)C=42)[C@@]3([H])C(C)(C)C1 |
|
| MolPort-046-593-352 |
0.80 |
CC(C)c1cc2[C@H]3C[C@H]4C(C)(C)CCC[C@@]4(C(=O)O3)c2c(O)c1O |
|
| MolPort-016-580-725 |
0.80 |
CC(C)c1cc2[C@@H]3C[C@H]4C(C)(C)CCC[C@]4(C(=O)O3)c2c(O)c1O |
|
| MolPort-001-741-284 |
0.80 |
CC(C)c1cc2C3CC4C(C)(C)CCCC4(C(=O)O3)c2c(O)c1O |
|
| MCULE-8929994145 |
0.80 |
C1CC23C(=O)OC(C4=C2C(O)=C(O)C(C(C)C)=C4)CC3C(C)(C)C1 |
|
| MCULE-6133390132 |
0.80 |
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 |
|
| MCULE-8916620297 |
0.80 |
[C@@]123CCCC(C)(C)[C@]1([H])C[C@H](OC2=O)C1C=C(C(O)=C(O)C3=1)C(C)C |
|
| MCULE-8524083865 |
0.80 |
O=C1[C@]23C4=C(C=C(C(C)C)C(O)=C4O)[C@](C[C@]2(C(C)(C)CCC3)[H])([H])O1 |
|
| MolPort-021-804-658 |
0.79 |
COC(=O)C1(C)C(CC(OC(C)=O)C2(C)C1C(OC(C)=O)C(O)c1cc(cc(O)c21)C(C)C)OC(C)=O |
|
| MCULE-9783089668 |
0.79 |
C1C(OC(C)=O)C2(C)C3C(O)=CC(C(C)C)=CC=3C(O)C(OC(C)=O)C2C(C)(C(=O)OC)C1OC(=O)C |
|
| MolPort-019-936-853 |
0.75 |
CC(C)c1cc2C(=O)[C@H]3OC(=O)[C@@]4(CCCC(C)(C)[C@H]34)c2c(O)c1O |
|
| MCULE-6816748251 |
0.75 |
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 |
|
| MolPort-007-559-791 |
0.74 |
CC(=O)OC1CC2(C)C(CCC2=O)C2CCc3cc(O)ccc3C12O |
|
| MCULE-7051039918 |
0.74 |
C12(O)C3C=CC(=CC=3CCC1([H])C1(C(C)(C(CC1)=O)CC2OC(C)=O)[H])O |
|
| MolPort-005-943-409 |
0.69 |
CC(C)c1cc2CC[C@H]3C(C)(C)CCC[C@]3(C(O)=O)c2c(O)c1O |
|
| MolPort-046-701-759 |
0.69 |
CC(C)c1cc2CCC3C(C)(C)CCCC3(C(O)=O)c2c(O)c1O |
|
| MolPort-021-804-475 |
0.69 |
COC(=O)CC1CC2(C(C)O1)C(=O)c1c(cccc1O)C2(O)C(=O)OC |
|
| MCULE-9962093975 |
0.69 |
C1C=C2C(O)(C(=O)OC)C3(CC(CC(=O)OC)OC3C)C(=O)C2=C(O)C=1 |
|
| MCULE-5689087287 |
0.69 |
C1(O)C(O)=C2[C@@]3(C(O)=O)CCCC(C)(C)[C@]3([H])CCC2=CC=1C(C)C |
|
| MCULE-5475851336 |
0.69 |
O=C(O)[C@@]12C3C(=C(C(=CC=3CC[C@@]1([H])C(C)(C)CCC2)C(C)C)O)O |
|
| MolPort-039-052-479 |
0.68 |
CC(C)c1cc2[C@H]3O[C@@H](O)C4(CCCC(C)(C)[C@@H]4[C@H]3O)c2c(O)c1O |
|
| MolPort-001-739-781 |
0.67 |
CC1CCCC2OC2C(=O)c2c(O)cc(O)cc2CC(=O)O1 |
|
| MolPort-001-739-660 |
0.67 |
COC1CCCC(C)OC(=O)Cc2cc(O)cc(O)c2C(=O)C1 |
|
| MolPort-039-338-881 |
0.67 |
CC(C)c1cc2[C@@H]3C[C@H]4C(C)(C)CCC[C@]4(CO3)c2c(O)c1O |
|
| MCULE-9076905699 |
0.67 |
C1(O)C=C2C(C(=O)CC(O)CCCC(C)OC(=O)C2)=C(O)C=1 |
|
| MCULE-6710301297 |
0.67 |
C1C(O)=C2C(CC(=O)OC(C)CCCC(OC)CC2=O)=CC=1O |
|
| MCULE-9322153084 |
0.67 |
C1(O)C=C2C(C(=O)C3OC3CCCC(C)OC(=O)C2)=C(O)C=1 |
|
| MolPort-021-804-662 |
0.66 |
COC(=O)C1(C)CCC(OC(C)=O)C2(C)C1C(OC(C)=O)C(=O)c1cc(cc(O)c21)C(C)C |
|
| MCULE-2303915706 |
0.66 |
C12(O)C(OC(=O)C)CC3(C)C(CCC3C1CCC1C=C(C=CC2=1)OC(=O)C)=O |
|
| MolPort-044-727-636 |
0.65 |
C[C@H]1CCCCCC(=O)c2c(O)cc(O)cc2CC(=O)O1 |
|
| MolPort-001-739-726 |
0.65 |
CC1CCCCCC(=O)c2c(O)cc(O)cc2CC(=O)O1 |
|
| MolPort-002-343-480 |
0.65 |
CCC1(O)CC(O)c2c(O)c3C(=O)c4ccccc4C(=O)c3cc2C1C(=O)OC |
|
| MCULE-7607181156 |
0.65 |
C12C(O)=C3C(O)CC(C(C(OC)=O)C3=CC=1C(C1=CC=CC=C1C2=O)=O)(CC)O |
|
| MCULE-9128498628 |
0.65 |
C1C(O)=C2C(CC(=O)OC(C)CCCCCC2=O)=CC=1O |
|
| MolPort-046-158-430 |
0.64 |
COc1c(O)c2c(CC[C@H]3C(C)(C)CCC[C@]23C(O)=O)cc1C(C)C |
|
| MolPort-007-559-789 |
0.64 |
CC(=O)OC1CC2(C)C(CCC2=O)C2CCc3cc(O)ccc3C12 |
|
| MolPort-001-740-834 |
0.64 |
COc1c(O)c2c(CCC3C(C)(C)CCC[C@]23C(O)=O)cc1C(C)C |
|
| MCULE-6464967141 |
0.64 |
O=C(CC1C(C(=O)CCCCCCCC)=C(O)C=C(O)C=1)OCCCCC |
|
| MCULE-7726007778 |
0.64 |
C12(C)C(=O)CCC1([H])C1(C([H])(C3C=CC(=CC=3CC1)O)C(OC(C)=O)C2)[H] |
|
| MolPort-021-804-661 |
0.63 |
COC(=O)[C@]1(C)C2[C@H](OC(C)=O)[C@@H](O)c3cc(cc(O)c3[C@@]2(C)C=CC1=O)C(C)C |
|
| MolPort-001-739-556 |
0.63 |
CC(OC(C)=O)[C@@H]1[C@@]23O[C@@]2([C@H](O)c2c(O)c(ccc2C3=O)-c2ccc3C(=O)[C@]45O[C@@]4([C@H](O)c3c2O)C(=O)C[C@](C)(O)[C@@H]5[C@@H](C)OC(C)=O)C(=O)C[C@]1(C)O |
|
| MCULE-8187022405 |
0.63 |
C1=C[C@]2(C)C3C(O)=CC(C(C)C)=CC=3[C@H](O)[C@@H](OC(C)=O)C2[C@@](C)(C(=O)OC)C1=O |
|
| MolPort-021-804-474 |
0.62 |
COC(=O)C1(C)CCCC2(C)C1C(O)C(O)c1cc(ccc21)C(C)C |
|
| MolPort-021-804-853 |
0.62 |
COC(=O)CC1CC23OC2(C(C)O1)C(=O)c1c(O)cccc1C3=O |
|
| MolPort-037-998-567 |
0.62 |
COC(=O)C1CCCc2cc(O)ccc12 |
|
| MolPort-039-338-788 |
0.62 |
OC(=O)C[C@H](C1[C@H](OC(=O)c2cc(O)c(O)c(O)c12)C(O)=O)C(O)=O |
|
| MCULE-2261900172 |
0.62 |
C12C=C(O)C(O)=C(O)C=1C([C@H](OC2=O)C(O)=O)[C@H](C(O)=O)CC(O)=O |
|
| MCULE-2481498287 |
0.62 |
COC(C1C2=C(C=C(C=C2)O)CCC1)=O |
|
| MCULE-8818803945 |
0.62 |
C1C=C2C(=O)C34OC3(C(C)OC(CC(=O)OC)C4)C(=O)C2=C(O)C=1 |
|
| MCULE-5907885217 |
0.62 |
[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 |
|
| MolPort-035-705-945 |
0.61 |
Cc1cc2[C@@H]3C[C@H]4C(C)(C)CCC[C@]4(CO3)c2cc1O |
|
| MolPort-021-804-852 |
0.61 |
CC1OC(CC(O)=O)CC23OC12C(=O)c1c(O)cccc1C3=O |
|
| MolPort-000-721-951 |
0.61 |
COc1cc2COC(=O)C3(CCCC3)c2cc1OC |
|
| MCULE-5121515075 |
0.61 |
C1C=C2C(=O)C34OC3(C(C)OC(CC(=O)O)C4)C(=O)C2=C(O)C=1 |
|
| MCULE-9970757448 |
0.61 |
C12=CC(OC)=C(C=C1COC(=O)C12CCCC1)OC |
|
| MCULE-8942661208 |
0.61 |
O=C1C2C3C4C=CC=CC=4C=CC=3C3CCCCC3C2C(=O)O1 |
|
| MolPort-021-804-567 |
0.60 |
CC1OC(CC(O)=O)CC2(O)C(=O)c3cccc(O)c3C(=O)C12O |
|
| MolPort-021-804-851 |
0.60 |
COC(=O)CC1CC2(O)C(=O)c3c(O)cccc3C(=O)C2(O)C(C)O1 |
|
| MolPort-001-797-725 |
0.60 |
O=C1CC(C2CC3C(C(=O)OC3=O)c3ccccc23)C(=O)O1 |
|
| MCULE-3068604046 |
0.60 |
C1C(O)=C2C(=O)C3(O)CC(CC(=O)OC)OC(C)C3(O)C(=O)C2=CC=1 |
|
| MCULE-9073160214 |
0.60 |
C1(CC2C(C(OC2=O)=O)C2C=CC=CC1=2)C1CC(=O)OC1=O |
|
| MCULE-5308660336 |
0.60 |
C12(CCC(C3=CC=CC=C13)O2)C(OC)=O |
|
| MCULE-5533174589 |
0.60 |
[C@@]12([H])[C@@]([H])(CCC3C(=CC(O)=C(C)C1=3)C)[C@@H](C(=O)O2)C |
|
| MCULE-2585612607 |
0.60 |
C1(C(CO)=CC(=C(OC)C=1)OC)C1(CCCC1)C(O)=O |
|
