| MolPort-046-593-352 |
1 |
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 |
1 |
CC(C)C1=C(O)C(O)=C2C(=C1)C1CC3C(C)(C)CCCC23C(=O)O1
|
|
| MolPort-016-580-725 |
1 |
CC(C)C1=CC2=C(C(O)=C1O)[C@@]13CCCC(C)(C)[C@@H]1C[C@@H]2OC3=O
|
|
| MCULE-8929994145 |
1 |
C1CC23C(=O)OC(C4=C2C(O)=C(O)C(C(C)C)=C4)CC3C(C)(C)C1
|
|
| MCULE-8916620297 |
1 |
[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 |
1 |
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 |
1 |
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-028-610-005 |
0.92 |
CC(C)C1=C(O)C(O)=C2C(=C1)[C@H]1OC(=O)[C@@]22CCCC(C)(C)C2[C@H]1O
|
|
| MolPort-046-790-464 |
0.85 |
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-039-338-881 |
0.85 |
CC(C)C1=CC2=C(C(O)=C1O)[C@@]13CCCC(C)(C)[C@@H]1C[C@@H]2OC3
|
|
| MCULE-5539175668 |
0.85 |
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-046-158-428 |
0.85 |
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
|
|
| MolPort-001-740-300 |
0.85 |
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-020-005-990 |
0.80 |
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 |
0.80 |
CC(C)C1=C(O)C(O)=C2C(=C1)C(O)[C@H]1OC(=O)[C@@]22CCCC(C)(C)C12
|
|
| MCULE-3956852366 |
0.80 |
[H][C@]12C(C)(C)CCC[C@@]31C1C([C@H](O)[C@H]2OC3=O)=CC(C(C)C)=C(O)C=1O
|
|
| MCULE-4924847499 |
0.77 |
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-019-936-760 |
0.77 |
COC1[C@H]2OC(=O)[C@@]3(CCCC(C)(C)[C@H]23)C2=C1C(OC)=C(C(C)C)C(O)=C2O
|
|
| MolPort-035-705-945 |
0.77 |
CC1=C(O)C=C2C(=C1)[C@@H]1C[C@H]3C(C)(C)CCC[C@]23CO1
|
|
| MCULE-9970757448 |
0.75 |
C12=CC(OC)=C(C=C1COC(=O)C12CCCC1)OC
|
|
| MolPort-000-721-951 |
0.75 |
COC1=CC2=C(C=C1OC)C1(CCCC1)C(=O)OC2
|
|
| MolPort-044-637-459 |
0.73 |
COC1=C(C(C)C)C(O)=C(O)C2=C1C(O)C1OC(=O)C22CCCC(C)(C)C12
|
|
| MolPort-021-804-659 |
0.73 |
COC(=O)C1(C)CCC(=O)C2(C)C1C(OC(C)=O)C(O)C1=C2C(O)=CC(=C1)C(C)C
|
|
| MCULE-3497484581 |
0.73 |
C1CC23C(=O)OC(C(O)C4C(OC)=C(C(C)C)C(O)=C(O)C=42)C3C(C)(C)C1
|
|
| MCULE-7423352455 |
0.73 |
C1C(=O)C2(C)C3C(O)=CC(C(C)C)=CC=3C(O)C(OC(C)=O)C2C(C)(C(=O)OC)C1
|
|
| MolPort-039-052-479 |
0.73 |
CC(C)C1=CC2=C(C(O)=C1O)C13CCCC(C)(C)[C@@H]1[C@@H](O)[C@@H]2O[C@H]3O
|
|
| MolPort-001-739-444 |
0.71 |
CCC1OC(=O)CC2=C1C=CC=C2O
|
|
| MCULE-5533174589 |
0.71 |
[C@@]12([H])[C@@]([H])(CCC3C(=CC(O)=C(C)C1=3)C)[C@@H](C(=O)O2)C
|
|
| MCULE-2400845301 |
0.71 |
C1(CC2C(=CC=CC=2C(CC)O1)O)=O
|
|
| MCULE-5475851336 |
0.70 |
O=C(O)[C@@]12C3C(=C(C(=CC=3CC[C@@]1([H])C(C)(C)CCC2)C(C)C)O)O
|
|
| MCULE-5689087287 |
0.70 |
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 |
0.70 |
CC(C)C1=C(O)C(O)=C2C(CC[C@H]3C(C)(C)CCC[C@]23C(O)=O)=C1
|
|
| MolPort-046-701-759 |
0.70 |
CC(C)C1=CC2=C(C(O)=C1O)C1(CCCC(C)(C)C1CC2)C(O)=O
|
|
| MolPort-039-052-174 |
0.69 |
Cl.NC[C@@H]1O[C@@H](CC2=C(O)C(O)=CC=C12)[C@@]12CC3CC(CC(C3)C1)C2
|
|
| MolPort-021-804-657 |
0.68 |
COC(=O)C1(C)CCC(O)C2(C)C1C(OC(C)=O)C(O)C1=C2C(O)=CC(=C1)C(C)C
|
|
| MolPort-021-804-656 |
0.68 |
COC(=O)C1(C)CCC(O)C2(C)C1C(OC(C)=O)C(O)C1=C2C=C(O)C(=C1)C(C)C
|
|
| MCULE-4462975930 |
0.68 |
C1C(O)C2(C)C3C(O)=CC(C(C)C)=CC=3C(O)C(OC(C)=O)C2C(C)(C(=O)OC)C1
|
|
| MolPort-007-559-791 |
0.67 |
CC(=O)OC1CC2(C)C(CCC2=O)C2CCC3=C(C=CC(O)=C3)C12O
|
|
| 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
|
|
| MCULE-7051039918 |
0.67 |
C12(O)C3C=CC(=CC=3CCC1([H])C1(C(C)(C(CC1)=O)CC2OC(C)=O)[H])O
|
|
| 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-1353927995 |
0.67 |
C1C(O)C2(C)C3C(O)=CC(C(C)C)=CC=3C(O)C(OC(C)=O)C2C(C)(C(=O)OC)C1O
|
|
| MolPort-021-804-654 |
0.67 |
COC(=O)C1(C)C(O)CC(O)C2(C)C1C(OC(C)=O)C(O)C1=C2C(O)=CC(=C1)C(C)C
|
|
| MolPort-039-338-826 |
0.66 |
CC1=C(O)C(=O)C=C2C(=C1)[C@@H]1C[C@H]3C(C)(C)CCC[C@]23CO1
|
|
| MolPort-002-509-938 |
0.66 |
COC1=CC2=C(COC(=O)C22CCCC2)C(Br)=C1OC
|
|
| MCULE-4759683011 |
0.66 |
[C@@H]12[C@@H](CCC3C(=CC(OC)=C(C)C1=3)C)[C@@H](C(=O)O2)C
|
|
| MCULE-5402543421 |
0.66 |
C12C=C(OC)C(=C(Br)C=1COC(=O)C12CCCC1)OC
|
|
| MCULE-5834716652 |
0.66 |
C1=CC=C2C(C(=O)OC(CCCC(C)=O)C2)=C1O
|
|
| MolPort-001-739-240 |
0.66 |
CC(=O)CCCC1CC2=C(C(=O)O1)C(O)=CC=C2
|
|
| MolPort-021-804-658 |
0.65 |
COC(=O)C1(C)C(CC(OC(C)=O)C2(C)C1C(OC(C)=O)C(O)C1=C2C(O)=CC(=C1)C(C)C)OC(C)=O
|
|
| MCULE-9783089668 |
0.65 |
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
|
|
| MCULE-2261900172 |
0.65 |
C12C=C(O)C(O)=C(O)C=1C([C@H](OC2=O)C(O)=O)[C@H](C(O)=O)CC(O)=O
|
|
| MolPort-039-338-788 |
0.65 |
OC(=O)C[C@H](C1[C@H](OC(=O)C2=C1C(O)=C(O)C(O)=C2)C(O)=O)C(O)=O
|
|
| MolPort-046-158-430 |
0.65 |
COC1=C(O)C2=C(CC[C@H]3C(C)(C)CCC[C@]23C(O)=O)C=C1C(C)C
|
|
| MolPort-001-740-834 |
0.65 |
COC1=C(C=C2CCC3C(C)(C)CCC[C@]3(C(O)=O)C2=C1O)C(C)C
|
|
| MolPort-009-625-176 |
0.64 |
COC1=CC=C(CC(=O)OC2CCCC3=CC=CC=C23)C=C1
|
|
| MolPort-001-739-726 |
0.64 |
CC1CCCCCC(=O)C2=C(O)C=C(O)C=C2CC(=O)O1
|
|
| MolPort-044-727-636 |
0.64 |
C[C@H]1CCCCCC(=O)C2=C(O)C=C(O)C=C2CC(=O)O1
|
|
| MCULE-7535032435 |
0.64 |
COC1=CC=C(CC(OC2C3=C(C=CC=C3)CCC2)=O)C=C1
|
|
| MCULE-6855430658 |
0.64 |
O1C2C1C1C=CC(OC)=C(OC)C=1CCC2
|
|
| MCULE-9128498628 |
0.64 |
C1C(O)=C2C(CC(=O)OC(C)CCCCCC2=O)=CC=1O
|
|
| MCULE-4414858012 |
0.64 |
C1(OC)C=C2C(=CC=1OC)C(C1C=CC(C(=O)OC)=CC=1)OC1CCCCC21
|
|
| MolPort-002-744-773 |
0.64 |
COC(=O)C1=CC=C(C=C1)C1OC2CCCCC2C2=C1C=C(OC)C(OC)=C2
|
|
| MolPort-002-508-435 |
0.63 |
COC1=C(OC)C=C2C(COCC22CCCC2)=C1
|
|
| MolPort-046-697-421 |
0.63 |
CCCCCCCC1CC2=CC(O)=C(C(O)=O)C(O)=C2CO1
|
|
| MCULE-6464967141 |
0.63 |
O=C(CC1C(C(=O)CCCCCCCC)=C(O)C=C(O)C=1)OCCCCC
|
|
| MCULE-4569172898 |
0.63 |
C1(=C(C2COC(CCCCCCC)CC=2C=C1O)O)C(O)=O
|
|
| MCULE-1276474815 |
0.63 |
C12=CC(OC)=C(C=C1C1CCCCC1OC2C1C=CC=C2C=CC=CC=12)OC
|
|
| MCULE-3037716283 |
0.63 |
C12CC(OC(C)=O)C3=C(C=CC(C(C)C)=C3)C1(C)CCCC2(C)C(OC)=O
|
|
| MolPort-002-744-680 |
0.63 |
COC1=CC2=C(C=C1OC)C(OC1CCCCC21)C1=CC=CC2=CC=CC=C12
|
|
| MolPort-000-124-380 |
0.63 |
COC(=O)C1(C)CCCC2(C)C1CC(OC(C)=O)C1=CC(=CC=C21)C(C)C
|
|
| MolPort-001-740-163 |
0.62 |
CC1CCCC(O)CC(=O)CC2=CC(O)=CC(O)=C2C(=O)O1
|
|
| MolPort-002-524-314 |
0.62 |
C[C@H]1[C@@H]2CCC3=C([C@@H]2OC1=O)C(C)=C(OC(C)=O)C=C3C
|
|
| MolPort-046-597-991 |
0.62 |
C[C@H]1C2CCC3=C([C@H]2OC1=O)C(C)=C(OC(C)=O)C=C3C
|
|
| MCULE-8141358305 |
0.62 |
C1(C=C2C(C(OC(C)CCCC(O)CC(=O)C2)=O)=C(O)C=1)O
|
|
| MCULE-4509750969 |
0.62 |
[C@@H]12[C@@]([H])(CCC3=C(C=C(OC(C)=O)C(C)=C13)C)[C@@H](C(=O)O2)C
|
|
| MCULE-9302085165 |
0.62 |
C1C(O)=CC(=C2C(=O)OC(CC=12)CCCCCCCCCC(O)C)O
|
|
| MCULE-9076905699 |
0.62 |
C1(O)C=C2C(C(=O)CC(O)CCCC(C)OC(=O)C2)=C(O)C=1
|
|
| MCULE-5308689680 |
0.62 |
C1(C=C2C(=CC=1OC)C(C1C=C(OC)C(OC)=C(OC)C=1)OC1CCCCC21)OC
|
|
| MolPort-006-668-476 |
0.62 |
CC(O)CCCCCCCCCC1CC2=CC(O)=CC(O)=C2C(=O)O1
|
|
| MolPort-004-955-565 |
0.62 |
COC1=CC(=CC(OC)=C1OC)C1OC2CCCCC2C2=CC(OC)=C(OC)C=C12
|
|
| MolPort-005-695-219 |
0.61 |
COC1=CC=CC(COC(=O)C2(CCCC2)C2=CC=C3OCCOC3=C2)=C1
|
|
| MolPort-001-739-781 |
0.61 |
CC1CCCC2OC2C(=O)C2=C(O)C=C(O)C=C2CC(=O)O1
|
|
| MolPort-016-584-264 |
0.61 |
COC1=CC2=C(C=C1OC)C1(CCCC1)COC2=O
|
|
| MolPort-007-559-789 |
0.61 |
CC(=O)OC1CC2(C)C(CCC2=O)C2CCC3=C(C=CC(O)=C3)C12
|
|
| MolPort-037-998-567 |
0.61 |
COC(=O)C1CCCC2=C1C=CC(O)=C2
|
|
| MolPort-001-739-301 |
0.61 |
CC(O)CCCC1CC2=C(C(=O)O1)C(O)=CC=C2
|
|
| MolPort-001-739-660 |
0.61 |
COC1CCCC(C)OC(=O)CC2=CC(O)=CC(O)=C2C(=O)C1
|
|
| MolPort-002-743-515 |
0.61 |
COC1=CC2=C(C=C1OC)C(OC1CCCCC21)C1=CC(OC)=C(OCC2=CC=CC=C2)C=C1
|
|
| MCULE-9792484538 |
0.61 |
COC1=CC(COC(C2(C3=CC4=C(OCCO4)C=C3)CCCC2)=O)=CC=C1
|
|
| MCULE-7726007778 |
0.61 |
C12(C)C(=O)CCC1([H])C1(C([H])(C3C=CC(=CC=3CC1)O)C(OC(C)=O)C2)[H]
|
|
| MCULE-8364430879 |
0.61 |
C12=CC(OC)=C(C=C1C1(COC2=O)CCCC1)OC
|
|
| MCULE-9322153084 |
0.61 |
C1(O)C=C2C(C(=O)C3OC3CCCC(C)OC(=O)C2)=C(O)C=1
|
|
| MCULE-2481498287 |
0.61 |
COC(C1C2=C(C=C(C=C2)O)CCC1)=O
|
|
| MCULE-6710301297 |
0.61 |
C1C(O)=C2C(CC(=O)OC(C)CCCC(OC)CC2=O)=CC=1O
|
|
| MCULE-4858628558 |
0.61 |
C1(=C(C=C2C(C3CCCCC3OC2C2C=CC(OCC3C=CC=CC=3)=C(OC)C=2)=C1)OC)OC
|
|
| MCULE-6577549494 |
0.61 |
COC1C(O)=C(O)C=C(C(O[C@H]2[C@@H](C3=CC(O)=C(O)C(O)=C3)CC3=C(C(=CC(=C3)O)O)C2)=O)C=1
|
|
| MCULE-5907885217 |
0.61 |
[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-9485887081 |
0.61 |
[C@@]12(CC[C@H](C(=O)O1)CC2)C1=CC=C(C(OC)=C1)OC
|
|
| MolPort-046-067-711 |
0.61 |
COC1=C(OC)C=C(C=C1)[C@@]12CC[C@@H](CC1)C(=O)O2
|
|
| MolPort-002-744-770 |
0.60 |
COC1=CC=CC(C2OC3CCCCC3C3=C2C=C(OC)C(OC)=C3)=C1OC
|
|
| MolPort-002-025-225 |
0.60 |
COC1=CC(C2OC3CCCCC3C3=C2C=C(OC)C(OC)=C3)=C(OC)C=C1
|
|
| MolPort-029-674-820 |
0.60 |
OC(=O)C1CCCC2=C1C=CC=C2O
|
|
| MolPort-002-739-816 |
0.60 |
COC1=CC2=C(C=C1OC)C(OC1CCCCC21)C1=CC(=CC=C1)C(F)(F)F
|
|
| MolPort-003-248-260 |
0.60 |
CC1CCCC(=O)CCCCCC2=CC(O)=CC(O)=C2C(=O)O1
|
|
| MolPort-001-017-583 |
0.60 |
C[C@H]1CCCC(=O)CCCCCC2=CC(O)=CC(O)=C2C(=O)O1
|
|
| MolPort-046-764-902 |
0.60 |
[2H]C([2H])([2H])C1([2H])OC(=O)C2=C(O)C=C(O)C=C2CCCCCC(=O)CCC1([2H])[2H]
|
|
| MCULE-1247054670 |
0.60 |
C1(C2=CC=CC(OC)=C2OC)OC2CCCCC2C2=CC(OC)=C(OC)C=C12
|
|
| MCULE-4046425285 |
0.60 |
C1(C=C2C(=CC=1OC)C(C1C(OC)=CC=C(OC)C=1)OC1CCCCC21)OC
|
|
| MCULE-2303915706 |
0.60 |
C12(O)C(OC(=O)C)CC3(C)C(CCC3C1CCC1C=C(C=CC2=1)OC(=O)C)=O
|
|
| MCULE-3110179120 |
0.60 |
OC(C1C2=C(C(=CC=C2)O)CCC1)=O
|
|
| MCULE-7935167395 |
0.60 |
C1(=C(OC)C=C2C(C3CCCCC3OC2C2C=C(C(F)(F)F)C=CC=2)=C1)OC
|
|
| MCULE-1900750226 |
0.60 |
C12CCCCCC(CCC[C@H](C)OC(=O)C=1C(O)=CC(O)=C2)=O
|
|
| MCULE-5743024129 |
0.60 |
CC1OC(=O)C2=C(C=C(C=C2O)O)CCCCCC(=O)CCC1
|
|
| MCULE-3874440992 |
0.60 |
C1=C2C(=CC3OCOC=31)C1CCCCC1OC2C1C=C2OCOC2=CC=1
|
|
| MCULE-8943840464 |
0.60 |
C1(C2=CC=C(Br)C=C2)OC2CCCCC2C2C=C(OC)C(OC)=CC1=2
|
|
| MCULE-5308660336 |
0.60 |
C12(CCC(C3=CC=CC=C13)O2)C(OC)=O
|
|
