| MCULE-8507299188 |
1 |
C123C4C(C)CCC1C(C)C(OC2OC(CC4)(C)OO3)=O |
|
| MCULE-9657976241 |
1 |
O1[C@@]23[C@@H]4OC([C@H](C)[C@@H]2CC[C@@H](C)[C@@H]3CC[C@](C)(O1)O4)=O |
|
| MCULE-5701587718 |
1 |
O1[C@]2(OC(=O)[C@H](C)[C@]3([H])CC[C@@H](C)[C@]4([H])CCC1(OO[C@]243)C)[H] |
|
| MCULE-9877817795 |
1 |
[C@]123[C@]4([H])[C@H](C)CC[C@@]1([H])[C@@H](C)C(O[C@]2([H])OC(CC4)(C)OO3)=O |
|
| MolPort-046-761-841 |
1 |
C[C@@H]1CC[C@@H]2[C@@H](C)C(=O)O[C@@H]3O[C@@]4(C)CC[C@@H]1[C@@]23OO4 |
|
| MolPort-046-147-854 |
1 |
C[C@@H]1CCC2[C@@H](C)C(=O)O[C@@H]3OC4(C)CC[C@@H]1[C@@]23OO4 |
|
| MolPort-046-765-277 |
1 |
C[C@H]1CC[C@H]2[C@@H](C)C(=O)O[C@H]3O[C@]4(C)CC[C@H]1[C@]23OO4 |
|
| MolPort-035-668-922 |
1 |
C[C@@H]1CCC2[C@@H](C)C(=O)O[C@@H]3O[C@]4(C)CCC1[C@@]23OO4 |
|
| MolPort-001-741-431 |
1 |
C[C@@H]1CCC2[C@@H](C)C(=O)OC3O[C@]4(C)CCC1[C@@]23OO4 |
|
| MolPort-002-692-529 |
1 |
CC1CCC2C(C)C(=O)OC3OC4(C)CCC1C23OO4 |
|
| MolPort-006-069-257 |
1 |
C[C@@H]1CC[C@H]2[C@@H](C)C(=O)O[C@@H]3O[C@@]4(C)CC[C@@H]1[C@@]23OO4 |
|
| MolPort-006-392-383 |
1 |
[2H]C([2H])([2H])[C@@H]1[C@@H]2CC[C@@H](C)[C@@H]3CC[C@@]4(C)OO[C@@]23[C@H](OC1=O)O4 |
|
| MolPort-008-322-122 |
1 |
C[C@@H]1CCC2[C@H](C)C(=O)O[C@@H]3O[C@]4(C)CCC1C23OO4 |
|
| MolPort-002-493-751 |
1 |
C[C@@H]1CC[C@H]2[C@@H](C)C(=O)O[C@@H]3O[C@]4(C)CC[C@@H]1[C@@]23OO4 |
|
| MolPort-046-765-276 |
1 |
C[C@H]1CC[C@H]2[C@@H](C)C(=O)O[C@@H]3O[C@]4(C)CC[C@H]1[C@]23OO4 |
|
| MolPort-046-765-551 |
0.91 |
C[C@@H]1CC[C@H]2C(=O)C(=O)O[C@@H]3O[C@@]4(C)CC[C@@H]1[C@@]23OO4 |
|
| MCULE-5572229176 |
0.88 |
[C@]123[C@]4([H])[C@]([H])(C)CC[C@@]1([H])[C@@]([H])(C)[C@@](O[C@]2([H])O[C@@](CC4)(C)OO3)([H])OC(CCC(O)=O)=O |
|
| MCULE-1229071455 |
0.88 |
C123C4([H])C(C)CCC1([H])C([H])(C)C(OC2([H])OC(CC4)(C)OO3)([H])OC(CCC(O)=O)=O |
|
| MCULE-8618759591 |
0.88 |
[C@@]12([H])CC[C@]3(C)OO[C@@]41[C@]([H])(O[C@H](OC(CCC(=O)O)=O)[C@H](C)[C@]4([H])CC[C@H]2C)O3 |
|
| MCULE-8865027836 |
0.88 |
C1C[C@@]2([H])[C@@](C)([H])CC[C@@]3([H])[C@](C)([H])[C@](OC(=O)CCC(O)=O)([H])O[C@@]4([H])[C@@]23OOC1(C)O4 |
|
| MCULE-7041587395 |
0.88 |
[C@]123[C@]4([H])[C@H](C)CC[C@@]1([H])[C@@]([H])(C)[C@](O[C@]2([H])OC(CC4)(C)OO3)([H])OC(CCC(O)=O)=O |
|
| MCULE-7545600820 |
0.88 |
C[C@H]1[C@@H]2CC[C@@]3(O[C@@H]4[C@]2(OO3)[C@H]([C@H]([C@@H](O4)OC(=O)CCC(=O)O)C)CC1)C |
|
| MCULE-6863576034 |
0.88 |
O1[C@]2(O[C@H](OC(CCC(O)=O)=O)[C@H](C)[C@]3([H])CC[C@@H](C)[C@]4([H])CCC1(OO[C@]243)C)[H] |
|
| MolPort-006-392-384 |
0.88 |
C[C@@H]1CC[C@H]2[C@@H](C)[C@H](OC(=O)CCC(O)=O)O[C@@H]3O[C@@]4(C)CC[C@@H]1[C@@]23OO4 |
|
| MolPort-006-069-124 |
0.88 |
C[C@@H]1CC[C@H]2[C@@H](C)[C@@H](OC(=O)CCC(O)=O)O[C@@H]3O[C@]4(C)CC[C@@H]1[C@@]23OO4 |
|
| MolPort-001-732-325 |
0.88 |
C[C@@H]1CC[C@H]2[C@@H](C)[C@H](OC(=O)CCC(O)=O)O[C@@H]3O[C@]4(C)CC[C@@H]1[C@@]23OO4 |
|
| MolPort-027-949-008 |
0.88 |
C[C@@H]1CC[C@H]2[C@@H](C)[C@@H](OC(=O)CCC(O)=O)O[C@@H]3O[C@@]4(C)CC[C@@H]1[C@@]23OO4 |
|
| MolPort-044-193-509 |
0.88 |
CC1CCC2C(C)C(OC(=O)CCC(O)=O)OC3OC4(C)CCC1C23OO4 |
|
| MolPort-046-688-543 |
0.88 |
[2H]C([2H])(C(O)=O)C([2H])([2H])C(=O)O[C@@H]1O[C@@H]2O[C@@]3(C)CC[C@H]4[C@H](C)CC[C@@H]([C@H]1C)[C@@]24OO3 |
|
| MolPort-042-675-791 |
0.88 |
C[C@@H]1CC[C@H]2[C@@H](C)[C@@H](OC(=O)CCC(O)=O)O[C@@H]3OC4(C)CC[C@@H]1[C@@]23OO4 |
|
| MCULE-5670381786 |
0.86 |
C[C@H]1[C@H]2[C@]34OO[C@](C)(CC2)O[C@H]3OC(=O)C(=C)[C@H]4CC1 |
|
| MolPort-046-688-567 |
0.86 |
C[C@@H]1CC[C@H]2C(=C)C(=O)O[C@@H]3O[C@@]4(C)CC[C@@H]1[C@@]23OO4 |
|
| MolPort-046-765-296 |
0.86 |
C[C@H]1CC[C@H]2C(=C)C(=O)O[C@H]3O[C@]4(C)CC[C@H]1[C@]23OO4 |
|
| MCULE-2113191726 |
0.78 |
[C@@]123OO[C@@]4(CC[C@@]1([H])[C@@H](CC[C@@]2([H])[C@H]([C@H](O)O[C@]3([H])O4)C)C)C |
|
| MCULE-1519933807 |
0.78 |
O[C@H]1[C@H](C)[C@@]2([H])[C@]34[C@@]([C@@H](CC2)C)([H])CC[C@](C)(O[C@@]3([H])O1)OO4 |
|
| MCULE-7681620599 |
0.78 |
C1C[C@@]2([H])[C@H](C)CC[C@]3([C@@H](C)[C@@H](O)O[C@H]4[C@@]23OOC1(C)O4)[H] |
|
| MCULE-2423150778 |
0.78 |
O1[C@]2(O[C@H](O)[C@H](C)[C@]3([H])CC[C@@H](C)[C@]4([H])CCC1(OO[C@]243)C)[H] |
|
| MCULE-8040777258 |
0.78 |
C123C4C(C)CCC1C(C)C(OC2OC(CC4)(C)OO3)O |
|
| MolPort-046-689-504 |
0.78 |
[2H]C([2H])([2H])[C@H]1[C@@H](O)O[C@@H]2O[C@@]3(C)CC[C@H]4[C@H](C)CC[C@@H]1[C@@]24OO3 |
|
| MolPort-001-732-330 |
0.78 |
C[C@@H]1CC[C@H]2[C@@H](C)[C@@H](O)O[C@@H]3O[C@]4(C)CC[C@@H]1C23OO4 |
|
| MolPort-023-220-349 |
0.78 |
C[C@@H]1CCC2[C@@H](C)C(O)O[C@@H]3O[C@]4(C)CCC1[C@@]23OO4 |
|
| MolPort-003-983-866 |
0.78 |
C[C@@H]1CCC2[C@@H](C)C(O)O[C@@H]3O[C@]4(C)CCC1[C@@]23OO4 |
|
| MolPort-009-198-667 |
0.78 |
C[C@@H]1CC[C@H]2[C@@H](C)[C@H](O)O[C@@H]3O[C@@]4(C)CC[C@@H]1[C@@]23OO4 |
|
| MolPort-035-868-724 |
0.78 |
C[C@@H]1CC[C@H]2[C@@H](C)[C@@H](O)O[C@@H]3O[C@@]4(C)CC[C@@H]1[C@@]23OO4 |
|
| MolPort-044-729-899 |
0.78 |
C[C@@H]1CCC2[C@@H](C)[C@@H](O)O[C@@H]3OC4(C)CC[C@@H]1[C@@]23OO4 |
|
| MolPort-001-732-326 |
0.78 |
C[C@@H]1CC[C@H]2[C@@H](C)C(O)O[C@@H]3O[C@]4(C)CC[C@@H]1[C@@]23OO4 |
|
| MolPort-046-069-207 |
0.78 |
C[C@@H]1CC[C@H]2[C@@H](C)C(O)O[C@@H]3O[C@@]4(C)CC[C@@H]1[C@@]23OO4 |
|
| MolPort-019-940-201 |
0.78 |
CC1CCC2C(C)C(O)OC3OC4(C)CCC1C23OO4 |
|
| MolPort-001-732-329 |
0.78 |
C[C@@H]1CC[C@H]2[C@@H](C)[C@@H](O)O[C@@H]3O[C@]4(C)CC[C@@H]1[C@@]23OO4 |
|
| MolPort-023-223-358 |
0.77 |
C[C@@H]1CC[C@H]2[C@@H](C)[C@H](OC3OC(C(O)C(O)C3O)C(O)=O)O[C@@H]3O[C@@]4(C)CC[C@@H]1C23OO4 |
|
| MolPort-046-765-754 |
0.77 |
C[C@H]1CC[C@@H]2[C@@H](C)C(O[C@@H]3OC([C@H](O)C(O)C3O)C(O)=O)O[C@H]3O[C@]4(C)CC[C@H]1[C@]23OO4 |
|
| MCULE-2963305380 |
0.76 |
O1[C@]2(O[C@H](OC)[C@H](C)[C@]3([H])CC[C@@H](C)[C@]4([H])CCC1(OO[C@]243)C)[H] |
|
| MCULE-1211612383 |
0.76 |
C[C@H]1[C@H](O[C@]2([H])O[C@@]3(C)CC[C@@]4([H])[C@H](C)CC[C@]1([H])[C@@]24OO3)OCC |
|
| MCULE-4660924372 |
0.76 |
O1[C@@H]2[C@]34OO[C@@](C)(O2)CC[C@H]3[C@@H](C)CC[C@H]4[C@@H](C)[C@@H]1OC |
|
| MCULE-9916057476 |
0.76 |
CO[C@@H]1[C@H](C)[C@H]2[C@]34OO[C@@](CC[C@H]3[C@@H](CC2)C)(C)O[C@H]4O1 |
|
| MCULE-4091829491 |
0.76 |
[C@@]123OO[C@@]4(CC[C@@]1([H])[C@@H](CC[C@@]2([H])[C@H]([C@@H](OCC)O[C@]3([H])O4)C)C)C |
|
| MCULE-1853364952 |
0.76 |
[C@]123[C@]4([H])[C@H](C)CC[C@@]1([H])[C@@H](C)[C@H](O[C@]2([H])O[C@@](CC4)(C)OO3)OC |
|
| MCULE-4503487010 |
0.76 |
[C@@]12([H])CC[C@]3(C)OO[C@@]41[C@]([H])(O[C@H](OC)[C@H](C)[C@]4([H])CC[C@H]2C)O3 |
|
| MolPort-023-220-418 |
0.76 |
CCO[C@H]1O[C@@H]2O[C@@]3(C)CC[C@H]4[C@H](C)CC[C@@H]([C@H]1C)[C@@]24OO3 |
|
| MolPort-016-633-324 |
0.76 |
CO[C@H]1O[C@@H]2O[C@]3(C)CC[C@H]4[C@H](C)CC[C@@H]([C@H]1C)[C@@]24OO3 |
|
| MolPort-001-732-355 |
0.76 |
C[C@@H]1CC[C@H]2[C@@H](C)[C@H](OC(=O)CCC(=O)NCCCCCC(O)=O)O[C@@H]3O[C@]4(C)CC[C@@H]1C23OO4 |
|
| MolPort-039-142-118 |
0.76 |
COC1OC2OC3(C)CCC4C(C)CCC(C1C)C24OO3 |
|
| MolPort-046-761-838 |
0.76 |
[2H]C([2H])([2H])O[C@H]1O[C@@H]2O[C@@]3(C)CC[C@H]4[C@H](C)CC[C@H]([C@H]1C)[C@@]24OO3 |
|
| MolPort-046-761-839 |
0.76 |
CO[C@H]1O[C@@H]2O[C@@]3(C)CC[C@H]4[C@H](C)CC[C@H]([C@H]1C)[C@@]24OO3 |
|
| MolPort-023-220-124 |
0.76 |
CO[C@H]1O[C@@H]2O[C@@]3(C)CC[C@H]4[C@H](C)CC[C@@H]([C@H]1C)[C@@]24OO3 |
|
| MolPort-046-688-618 |
0.76 |
[2H]C([2H])([2H])O[C@@H]1O[C@@H]2O[C@@]3(C)CC[C@H]4[C@H](C)CC[C@@H]([C@H]1C)[C@@]24OO3 |
|
| MolPort-046-688-617 |
0.76 |
CO[C@@H]1O[C@@H]2O[C@@]3(C)CC[C@H]4[C@H](C)CC[C@@H]([C@H]1C)[C@@]24OO3 |
|
| MCULE-4004362283 |
0.75 |
C123[C@]4([H])[C@H](C)CCC1([H])C([H])(C)C(O[C@@]2([H])OC(CC4)(C)OO3)([H])OC(CCC(NCCCC(O)=O)=O)=O |
|
| MCULE-8771366634 |
0.75 |
C123[C@]4([H])[C@H](C)CCC1([H])C([H])(C)C(O[C@@]2([H])OC(CC4)(C)OO3)([H])OC(CCC(=O)NC(C)CC)=O |
|
| MolPort-001-732-367 |
0.75 |
C[C@@H]1CCC2C(C)C(OC(=O)CCC(=O)NCCCC(O)=O)O[C@H]3OC4(C)CC[C@@H]1C23OO4 |
|
| MolPort-001-732-372 |
0.75 |
CC(C)CNC(=O)CCC(=O)O[C@@H]1O[C@@H]2O[C@]3(C)CC[C@H]4[C@H](C)CC[C@@H]([C@H]1C)C24OO3 |
|
| MolPort-001-732-359 |
0.75 |
C[C@@H]1CC[C@H]2[C@@H](C)[C@H](OC(=O)CCC(=O)NCC3CCCCC3)O[C@@H]3O[C@]4(C)CC[C@@H]1C23OO4 |
|
| MolPort-001-732-363 |
0.75 |
CCC(C)NC(=O)CCC(=O)OC1O[C@H]2OC3(C)CC[C@H]4[C@H](C)CCC(C1C)C24OO3 |
|
| MCULE-9317220846 |
0.73 |
C123[C@]4([H])[C@H](C)CCC1([H])C([H])(C)C(O[C@@]2([H])OC(CC4)(C)OO3)([H])OC(CCC(=O)NC(C)(C)CO)=O |
|
| MolPort-001-732-361 |
0.73 |
C[C@@H]1CCC2C(C)C(OC(=O)CCC(=O)NC(C)(C)CO)O[C@H]3OC4(C)CC[C@@H]1C23OO4 |
|
| MCULE-5551837200 |
0.72 |
C123C4C(C)CCC1C(C)C(OC2OC(CC4)(C)OO3)OC(CCC(NCCCN1CCCC1=O)=O)=O |
|
| MolPort-000-781-823 |
0.72 |
C[C@@H]1CC[C@H]2[C@@H](C)[C@H](OC(=O)CCC(=O)NC(CC(O)=O)C3CCOC(C)(C)C3)O[C@@H]3O[C@]4(C)CC[C@@H]1C23OO4 |
|
| MolPort-001-732-343 |
0.72 |
C[C@@H]1CC[C@H]2[C@@H](C)[C@H](OC(=O)CCC(=O)NCC(C)(C)C(O)C(O)=O)O[C@@H]3O[C@]4(C)CC[C@@H]1C23OO4 |
|
| MolPort-035-669-084 |
0.72 |
C[C@@H]1CCC2[C@@H](C)[C@H](OC(=O)CCC(=O)NCCCN3CCCC3=O)O[C@@H]3O[C@]4(C)CCC1[C@@]23OO4 |
|
| MolPort-001-732-381 |
0.71 |
C[C@@H]1CC[C@H]2[C@@H](C)[C@H](OC(=O)CCC(=O)N[C@@H](CCC(O)=O)C(O)=O)O[C@@H]3O[C@]4(C)CC[C@@H]1C23OO4 |
|
| MolPort-001-732-360 |
0.71 |
COC(CNC(=O)CCC(=O)O[C@@H]1O[C@@H]2O[C@]3(C)CC[C@H]4[C@H](C)CC[C@@H]([C@H]1C)C24OO3)OC |
|
| MolPort-001-732-353 |
0.71 |
CC(NC(=O)CCC(=O)O[C@@H]1O[C@@H]2O[C@]3(C)CC[C@H]4[C@H](C)CC[C@@H]([C@H]1C)C24OO3)C(O)=O |
|
| MolPort-001-732-357 |
0.71 |
C[C@@H]1CC[C@H]2[C@@H](C)[C@H](OC(=O)CCC(=O)NCC(O)=O)O[C@@H]3O[C@]4(C)CC[C@@H]1C23OO4 |
|
| MolPort-001-732-376 |
0.70 |
CC(C)CC(NC(=O)CCC(=O)O[C@@H]1O[C@@H]2O[C@]3(C)CC[C@H]4[C@H](C)CC[C@@H]([C@H]1C)C24OO3)C(O)=O |
|
| MolPort-000-786-575 |
0.70 |
CCC(C)C(NC(=O)CCCNC(=O)CCC(=O)OC1O[C@H]2OC3(C)CC[C@H]4[C@H](C)CCC(C1C)C24OO3)C(O)=O |
|
| MolPort-001-732-347 |
0.70 |
C[C@@H]1CC[C@H]2[C@@H](C)[C@H](OC(=O)CCC(=O)NC(CO)C(O)=O)O[C@@H]3O[C@]4(C)CC[C@@H]1C23OO4 |
|
| MolPort-001-732-366 |
0.70 |
CC(C)C(NC(=O)CCC(=O)O[C@@H]1O[C@@H]2O[C@]3(C)CC[C@H]4[C@H](C)CC[C@@H]([C@H]1C)C24OO3)C(O)=O |
|
| MolPort-001-732-358 |
0.70 |
CCC(C)C(NC(=O)CCC(=O)O[C@@H]1O[C@@H]2O[C@]3(C)CC[C@H]4[C@H](C)CC[C@@H]([C@H]1C)C24OO3)C(O)=O |
|
| MCULE-6675967856 |
0.70 |
C123[C@]4([H])[C@H](C)CCC1([H])C([H])(C)C(O[C@@]2([H])OC(CC4)(C)OO3)([H])OC(CCC(NCCCC(=O)NC(CC(C)C)C(O)=O)=O)=O |
|
| MCULE-4259783245 |
0.70 |
C123[C@]4([H])[C@H](C)CCC1([H])C([H])(C)C(O[C@@]2([H])OC(CC4)(C)OO3)([H])OC(CCC(NCCCC(=O)NC(C(C)CC)C(O)=O)=O)=O |
|
| MolPort-000-797-186 |
0.70 |
CC(C)CC(NC(=O)CCCNC(=O)CCC(=O)OC1O[C@H]2OC3(C)CC[C@H]4[C@H](C)CCC(C1C)C24OO3)C(O)=O |
|
| MolPort-035-669-075 |
0.69 |
C[C@@H]1CCC2[C@@H](C)[C@H](OC(=O)CCC(=O)N(C)CC(O)C(O)C(O)C(O)CO)O[C@@H]3O[C@]4(C)CCC1[C@@]23OO4 |
|
| MolPort-000-804-023 |
0.69 |
CC(C)C(NC(=O)CCCNC(=O)CCC(=O)OC1O[C@H]2OC3(C)CC[C@H]4[C@H](C)CCC(C1C)C24OO3)C(O)=O |
|
| MolPort-001-732-384 |
0.69 |
CC(C)[C@H](NC(=O)CCCNC(=O)CCC(=O)O[C@@H]1O[C@@H]2O[C@]3(C)CC[C@H]4[C@H](C)CC[C@@H]([C@H]1C)[C@@]24OO3)C(O)=O |
|
| MolPort-001-732-370 |
0.69 |
CC(NC(=O)CCCNC(=O)CCC(=O)OC1O[C@H]2OC3(C)CC[C@H]4[C@H](C)CCC(C1C)C24OO3)C(O)=O |
|
| MolPort-001-732-369 |
0.69 |
C[C@@H]1CC[C@H]2[C@@H](C)[C@H](OC(=O)CCC(=O)NC(CCC(N)=O)C(O)=O)O[C@@H]3O[C@]4(C)CC[C@@H]1C23OO4 |
|
| MolPort-001-732-339 |
0.69 |
C[C@@H]1CC[C@H]2[C@@H](C)[C@H](OC(=O)CCC(=O)N3CCCC3C(O)=O)O[C@@H]3O[C@]4(C)CC[C@@H]1C23OO4 |
|
| MolPort-001-732-349 |
0.69 |
CC(O)C(NC(=O)CCC(=O)O[C@@H]1O[C@@H]2O[C@]3(C)CC[C@H]4[C@H](C)CC[C@@H]([C@H]1C)C24OO3)C(O)=O |
|
| MCULE-8161727817 |
0.69 |
C123[C@]4([H])[C@H](C)CCC1([H])C([H])(C)C(O[C@@]2([H])OC(CC4)(C)OO3)([H])OC(CCC(NCCCC(=O)NC(C)C(O)=O)=O)=O |
|
| MCULE-7218410797 |
0.69 |
C123[C@]4([H])[C@H](C)CCC1([H])C([H])(C)C(O[C@@]2([H])OC(CC4)(C)OO3)([H])OC(CCC(NCCCC(=O)NC(C(C)C)C(O)=O)=O)=O |
|
| MCULE-4011577340 |
0.69 |
[C@]123[C@]4([H])[C@H](C)CC[C@@]1([H])[C@@]([H])(C)[C@](O[C@]2([H])OC(CC4)(C)OO3)([H])OC(CCC(NCCCC(=O)N[C@@H](C(C)C)C(O)=O)=O)=O |
|
| MCULE-9070793794 |
0.69 |
C123C4C(C)CCC1C(C)C(OC2OC(CC4)(C)OO3)OC(CCC(=O)N(C)CC(O)C(O)C(O)C(CO)O)=O |
|
| MolPort-000-807-934 |
0.68 |
CC(O)C(NC(=O)CCCNC(=O)CCC(=O)OC1O[C@H]2OC3(C)CC[C@H]4[C@H](C)CCC(C1C)C24OO3)C(O)=O |
|
| MolPort-001-732-374 |
0.68 |
C[C@@H]1CC[C@H]2[C@@H](C)[C@H](OC(=O)CCC(=O)NCC3CCCO3)O[C@@H]3O[C@]4(C)CC[C@@H]1C23OO4 |
|
| MolPort-035-669-082 |
0.68 |
CCOC(=O)C1CCCN(C1)C(=O)CCC(=O)O[C@@H]1O[C@@H]2O[C@]3(C)CCC4[C@H](C)CCC([C@H]1C)[C@@]24OO3 |
|
| MCULE-1299879722 |
0.68 |
C123C4C(C)CCC1C(C)C(OC2OC(CC4)(C)OO3)OC(CCC(=O)N1CCCC(C(OCC)=O)C1)=O |
|
| MCULE-4320856132 |
0.68 |
C123[C@]4([H])[C@H](C)CCC1([H])C([H])(C)C(O[C@@]2([H])OC(CC4)(C)OO3)([H])OC(CCC(NCCCC(=O)NC(C(C)O)C(O)=O)=O)=O |
|
| MolPort-001-732-373 |
0.67 |
COC(=O)C1CCCN1C(=O)CCC(=O)O[C@@H]1O[C@@H]2O[C@]3(C)CC[C@H]4[C@H](C)CC[C@@H]([C@H]1C)C24OO3 |
|
| MolPort-001-732-389 |
0.66 |
CC(C)C[C@H](NC(=O)[C@H](CC(C)C)NC(=O)CCC(=O)O[C@@H]1O[C@@H]2O[C@]3(C)CC[C@H]4[C@H](C)CC[C@@H]([C@H]1C)[C@@]24OO3)C(O)=O |
|
| MolPort-000-810-918 |
0.66 |
CC(C)CC(NC(=O)C(CC(C)C)NC(=O)CCC(=O)OC1O[C@H]2OC3(C)CC[C@H]4[C@H](C)CCC(C1C)C24OO3)C(O)=O |
|
| MolPort-001-732-402 |
0.66 |
CC(C)C[C@H](NC(=O)CCC(=O)O[C@@H]1O[C@@H]2O[C@]3(C)CC[C@H]4[C@H](C)CC[C@@H]([C@H]1C)[C@@]24OO3)C(=O)NCC(O)=O |
|
| MolPort-001-732-354 |
0.66 |
C[C@@H]1CC[C@H]2[C@@H](C)[C@H](OC(=O)CCC(=O)N3CC(O)CC3C(O)=O)O[C@@H]3O[C@]4(C)CC[C@@H]1C23OO4 |
|
| MolPort-001-732-400 |
0.66 |
CC(C)C[C@H](NC(=O)CCC(=O)O[C@@H]1O[C@@H]2O[C@]3(C)CC[C@H]4[C@H](C)CC[C@@H]([C@H]1C)[C@@]24OO3)C(=O)N[C@@H](C)C(O)=O |
|
| MolPort-001-732-397 |
0.66 |
CC(C)C[C@H](NC(=O)CCC(=O)O[C@@H]1O[C@@H]2O[C@]3(C)CC[C@H]4[C@H](C)CC[C@@H]([C@H]1C)[C@@]24OO3)C(=O)N[C@@H](C(C)C)C(O)=O |
|
| MolPort-000-822-469 |
0.66 |
CC(C)CC(NC(=O)CCC(=O)OC1O[C@H]2OC3(C)CC[C@H]4[C@H](C)CCC(C1C)C24OO3)C(=O)NC(C)C(O)=O |
|
| MolPort-001-732-396 |
0.66 |
C[C@@H]1CC[C@H]2[C@@H](C)[C@H](OC(=O)CCC(=O)N[C@@H](CC(N)=O)C(O)=O)O[C@@H]3O[C@]4(C)CC[C@@H]1C23OO4 |
|
| MolPort-001-732-388 |
0.66 |
C[C@@H]1CC[C@H]2[C@@H](C)[C@H](OC(=O)CCC(=O)N[C@@H](CC(O)=O)C(O)=O)O[C@@H]3O[C@]4(C)CC[C@@H]1C23OO4 |
|
| MolPort-000-818-994 |
0.66 |
CC(C)CC(NC(=O)CCC(=O)OC1O[C@H]2OC3(C)CC[C@H]4[C@H](C)CCC(C1C)C24OO3)C(=O)NCC(O)=O |
|
| MolPort-000-814-947 |
0.66 |
CC(C)CC(NC(=O)CCC(=O)OC1O[C@H]2OC3(C)CC[C@H]4[C@H](C)CCC(C1C)C24OO3)C(=O)NC(C(C)C)C(O)=O |
|
| MolPort-000-794-589 |
0.66 |
CCC(C)C(NC(=O)C(CC(C)C)NC(=O)CCC(=O)OC1O[C@H]2OC3(C)CC[C@H]4[C@H](C)CCC(C1C)C24OO3)C(O)=O |
|
| MolPort-001-732-387 |
0.66 |
CCC(C)[C@H](NC(=O)[C@H](CC(C)C)NC(=O)CCC(=O)O[C@@H]1O[C@@H]2O[C@]3(C)CC[C@H]4[C@H](C)CC[C@@H]([C@H]1C)[C@@]24OO3)C(O)=O |
|
| MolPort-001-732-362 |
0.66 |
C[C@@H]1CC[C@H]2[C@@H](C)[C@H](OC(=O)CCC(=O)NCCC3=CCCCC3)O[C@@H]3O[C@]4(C)CC[C@@H]1C23OO4 |
|
| MolPort-001-732-334 |
0.66 |
C[C@@H]1CC[C@H]2[C@@H](C)[C@H](OC(=O)CCC(=O)NCCc3ccccc3)O[C@@H]3O[C@]4(C)CC[C@@H]1C23OO4 |
|
| MolPort-001-732-403 |
0.66 |
CC(C)C[C@H](NC(=O)CCC(=O)O[C@@H]1O[C@@H]2O[C@]3(C)CC[C@H]4[C@H](C)CC[C@@H]([C@H]1C)[C@@]24OO3)C(=O)N[C@@H](CCC(O)=O)C(O)=O |
|
| MolPort-000-814-189 |
0.66 |
CC(C)CC(NC(=O)CCC(=O)OC1O[C@H]2OC3(C)CC[C@H]4[C@H](C)CCC(C1C)C24OO3)C(=O)NC(CCC(O)=O)C(O)=O |
|
| MolPort-035-669-081 |
0.66 |
CCOC(=O)N1CCN(CC1)C(=O)CCC(=O)O[C@@H]1O[C@@H]2O[C@]3(C)CCC4[C@H](C)CCC([C@H]1C)[C@@]24OO3 |
|
| MCULE-4127050943 |
0.66 |
C123[C@]4([H])[C@H](C)CCC1([H])C([H])(C)C(O[C@@]2([H])OC(CC4)(C)OO3)([H])OC(CCC(=O)NC(CC(C)C)C(=O)NC(CCC(O)=O)C(O)=O)=O |
|
| MCULE-3734798004 |
0.66 |
[C@]123[C@]4([H])[C@H](C)CC[C@@]1([H])[C@@]([H])(C)[C@](O[C@]2([H])OC(CC4)(C)OO3)([H])OC(CCC(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCC(O)=O)C(O)=O)=O |
|
| MCULE-9958727618 |
0.66 |
C123C4C(C)CCC1C(C)C(OC2OC(CC4)(C)OO3)OC(CCC(=O)N1CCN(CC1)C(OCC)=O)=O |
|
| MCULE-7349537494 |
0.66 |
C123[C@]4([H])[C@H](C)CCC1([H])C([H])(C)C(O[C@@]2([H])OC(CC4)(C)OO3)([H])OC(CCC(=O)NC(CC(C)C)C(=O)NC(C(C)CC)C(O)=O)=O |
|
| MCULE-4628533506 |
0.66 |
C123[C@]4([H])[C@H](C)CCC1([H])C([H])(C)C(O[C@@]2([H])OC(CC4)(C)OO3)([H])OC(CCC(=O)NC(CC(C)C)C(=O)NC(C)C(O)=O)=O |
|
| MCULE-7480473591 |
0.66 |
C123[C@]4([H])[C@H](C)CCC1([H])C([H])(C)C(O[C@@]2([H])OC(CC4)(C)OO3)([H])OC(CCC(=O)NC(CC(C)C)C(=O)NCC(O)=O)=O |
|
| MCULE-9414492644 |
0.66 |
C123[C@]4([H])[C@H](C)CCC1([H])C([H])(C)C(O[C@@]2([H])OC(CC4)(C)OO3)([H])OC(CCC(=O)NC(CC(C)C)C(=O)NC(C(C)C)C(O)=O)=O |
|
| MCULE-6365344819 |
0.66 |
[C@]123[C@]4([H])[C@H](C)CC[C@@]1([H])[C@@]([H])(C)[C@](O[C@]2([H])OC(CC4)(C)OO3)([H])OC(CCC(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(C)C)C(O)=O)=O |
|
| MCULE-8764772808 |
0.66 |
[C@]123[C@]4([H])[C@H](C)CC[C@@]1([H])[C@@]([H])(C)[C@](O[C@]2([H])OC(CC4)(C)OO3)([H])OC(CCC(=O)N[C@@H](CC(C)C)C(=O)NCC(O)=O)=O |
|
| MCULE-8815008901 |
0.66 |
[C@]123[C@]4([H])[C@H](C)CC[C@@]1([H])[C@@]([H])(C)[C@](O[C@]2([H])OC(CC4)(C)OO3)([H])OC(CCC(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](C(C)C)C(O)=O)=O |
|
| MCULE-4136975196 |
0.66 |
[C@]123[C@]4([H])[C@H](C)CC[C@@]1([H])[C@@]([H])(C)[C@](O[C@]2([H])OC(CC4)(C)OO3)([H])OC(CCC(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](C)C(O)=O)=O |
|
| MCULE-8486268041 |
0.66 |
C123[C@]4([H])[C@H](C)CCC1([H])C([H])(C)C(O[C@@]2([H])OC(CC4)(C)OO3)([H])OC(CCC(=O)NC(CC(C)C)C(=O)NC(CC(C)C)C(O)=O)=O |
|
| MolPort-001-732-395 |
0.65 |
CC(C)C[C@H](NC(=O)CCC(=O)O[C@@H]1O[C@@H]2O[C@]3(C)CC[C@H]4[C@H](C)CC[C@@H]([C@H]1C)[C@@]24OO3)C(=O)N[C@@H](CO)C(O)=O |
|
| MolPort-001-732-382 |
0.65 |
CC(C)C[C@H](NC(=O)CCC(=O)O[C@@H]1O[C@@H]2O[C@]3(C)CC[C@H]4[C@H](C)CC[C@@H]([C@H]1C)[C@@]24OO3)C(=O)N[C@@H](C(C)O)C(O)=O |
|
| MolPort-000-784-323 |
0.65 |
CC(C)CC(NC(=O)CCC(=O)OC1O[C@H]2OC3(C)CC[C@H]4[C@H](C)CCC(C1C)C24OO3)C(=O)NC(CO)C(O)=O |
|
| MolPort-000-784-725 |
0.65 |
CC(C)CC(NC(=O)CCC(=O)OC1O[C@H]2OC3(C)CC[C@H]4[C@H](C)CCC(C1C)C24OO3)C(=O)NC(C(C)O)C(O)=O |
|
| MolPort-001-732-332 |
0.65 |
CC(NC(=O)CCC(=O)O[C@@H]1O[C@@H]2O[C@]3(C)CC[C@H]4[C@H](C)CC[C@@H]([C@H]1C)C24OO3)c1ccccc1 |
|
| MolPort-035-669-074 |
0.65 |
C[C@@H]1CCC2[C@@H](C)[C@H](OC(=O)CCC(=O)NN3CCOCC3)O[C@@H]3O[C@]4(C)CCC1[C@@]23OO4 |
|
| MCULE-4593006574 |
0.65 |
C123[C@]4([H])[C@H](C)CCC1([H])C([H])(C)C(O[C@@]2([H])OC(CC4)(C)OO3)([H])OC(CCC(=O)NC(CC(C)C)C(=O)NC(C(C)O)C(O)=O)=O |
|
| MCULE-1550919376 |
0.65 |
C123[C@]4([H])[C@H](C)CCC1([H])C([H])(C)C(O[C@@]2([H])OC(CC4)(C)OO3)([H])OC(CCC(=O)NC(CC(C)C)C(=O)NC(CO)C(O)=O)=O |
|
| MCULE-4190102049 |
0.65 |
C123C4C(C)CCC1C(C)C(OC2OC(CC4)(C)OO3)OC(CCC(=O)NN1CCOCC1)=O |
|
| MolPort-001-732-341 |
0.64 |
C[C@@H]1CC[C@H]2[C@@H](C)[C@H](OC(=O)CCC(=O)NCc3ccc(F)cc3)O[C@@H]3O[C@]4(C)CC[C@@H]1C23OO4 |
|
| MolPort-001-732-377 |
0.64 |
C[C@@H]1CCC2C(C)C(OC(=O)CCC(=O)NCCCC(=O)NC(CS)C(O)=O)O[C@H]3OC4(C)CC[C@@H]1C23OO4 |
|
| MCULE-1465356045 |
0.64 |
C123[C@]4([H])[C@H](C)CCC1([H])C([H])(C)C(O[C@@]2([H])OC(CC4)(C)OO3)([H])OC(CCC(NCCCC(=O)NC(CS)C(O)=O)=O)=O |
|
| MolPort-001-732-371 |
0.63 |
C[C@@H]1CC[C@H]2[C@@H](C)[C@H](OC(=O)CCC(=O)ON3C(=O)CCC3=O)O[C@@H]3O[C@]4(C)CC[C@@H]1C23OO4 |
|
| MolPort-001-732-346 |
0.63 |
C[C@@H]1CC[C@H]2[C@@H](C)[C@H](OC(=O)CCC(=O)NCCc3ccc(F)cc3)O[C@@H]3O[C@]4(C)CC[C@@H]1C23OO4 |
|
| MolPort-001-732-390 |
0.63 |
C[C@@H]1CC[C@H]2[C@@H](C)[C@H](OC(=O)CCC(=O)NCCc3ccc(O)cc3)O[C@@H]3O[C@]4(C)CC[C@@H]1C23OO4 |
|
| MolPort-001-732-335 |
0.63 |
C[C@@H]1CC[C@H]2[C@@H](C)[C@H](OC(=O)CCC(=O)NCC(CC(O)=O)c3ccccc3)O[C@@H]3O[C@]4(C)CC[C@@H]1C23OO4 |
|
| MolPort-001-732-351 |
0.62 |
C[C@@H]1CC[C@H]2[C@@H](C)[C@H](OC(=O)CCC(=O)NCCc3ccc(O)c(O)c3)O[C@@H]3O[C@]4(C)CC[C@@H]1C23OO4 |
|
| MolPort-001-732-340 |
0.62 |
C[C@@H]1CC[C@H]2[C@@H](C)[C@H](OC(=O)CCC(=O)NCc3ccc(cc3)C(O)=O)O[C@@H]3O[C@]4(C)CC[C@@H]1C23OO4 |
|
| MolPort-001-732-378 |
0.62 |
C[C@@H]1CCC2C(C)C(OC(=O)CCC(=O)NCCCC(=O)NCCc3ccc(O)c(O)c3)O[C@H]3OC4(C)CC[C@@H]1C23OO4 |
|
| MolPort-001-732-352 |
0.62 |
COc1ccc(CNC(=O)CCC(=O)O[C@@H]2O[C@@H]3O[C@]4(C)CC[C@H]5[C@H](C)CC[C@@H]([C@H]2C)C35OO4)cc1 |
|
| MolPort-035-669-078 |
0.62 |
C[C@@H]1CCC2[C@@H](C)[C@H](OC(=O)CCC(=O)NCCc3ccc(O)c(O)c3)O[C@@H]3O[C@]4(C)CCC1[C@@]23OO4 |
|
| MolPort-001-732-333 |
0.62 |
C[C@@H]1CC[C@H]2[C@@H](C)[C@H](OC(=O)CCC(=O)NCc3ccncc3)O[C@@H]3O[C@]4(C)CC[C@@H]1C23OO4 |
|
| MCULE-4970665058 |
0.62 |
C123C4C(C)CCC1C(C)C(OC2OC(CC4)(C)OO3)OC(CCC(NCCC1C=CC(=C(O)C=1)O)=O)=O |
|
| MCULE-1354257230 |
0.62 |
C123[C@]4([H])[C@H](C)CCC1([H])C([H])(C)C(O[C@@]2([H])OC(CC4)(C)OO3)([H])OC(CCC(NCCCC(NCCC1=CC=C(C(O)=C1)O)=O)=O)=O |
|
| MolPort-001-732-338 |
0.61 |
CSCCC(NC(=O)CCC(=O)O[C@@H]1O[C@@H]2O[C@]3(C)CC[C@H]4[C@H](C)CC[C@@H]([C@H]1C)C24OO3)C(O)=O |
|
| MolPort-001-732-365 |
0.61 |
C[C@@H]1CC[C@H]2[C@@H](C)[C@H](OC(=O)CCC(=O)NCc3ccco3)O[C@@H]3O[C@]4(C)CC[C@@H]1C23OO4 |
|
| MolPort-001-732-399 |
0.61 |
CC(C)C[C@H](NC(=O)CCC(=O)O[C@@H]1O[C@@H]2O[C@]3(C)CC[C@H]4[C@H](C)CC[C@@H]([C@H]1C)[C@@]24OO3)C(=O)N[C@@H](CS)C(O)=O |
|
| MolPort-000-814-000 |
0.61 |
CC(C)CC(NC(=O)CCC(=O)OC1O[C@H]2OC3(C)CC[C@H]4[C@H](C)CCC(C1C)C24OO3)C(=O)NC(CS)C(O)=O |
|
| MolPort-001-732-375 |
0.61 |
COc1ccc(CCNC(=O)CCC(=O)O[C@@H]2O[C@@H]3O[C@]4(C)CC[C@H]5[C@H](C)CC[C@@H]([C@H]2C)C35OO4)cc1 |
|
| MolPort-035-669-071 |
0.61 |
C[C@@H]1CC[C@@H]2[C@@H](C)C(OC(=O)CCC(=O)N3CCN(CC3)C(c3ccccc3)c3ccccc3)O[C@@H]3O[C@]4(C)CCC1[C@@]23OO4 |
|
| MolPort-035-669-073 |
0.61 |
C[C@@H]1CC[C@@H]2[C@@H](C)C(OC(=O)c3cccnc3)O[C@@H]3O[C@]4(C)CCC1[C@@]23OO4 |
|
| MolPort-035-669-087 |
0.61 |
C[C@@H]1CC[C@@H]2[C@@H](C)C(OC(=O)CCC(=O)NCc3ccc(CN4CCOCC4)cc3)O[C@@H]3O[C@]4(C)CCC1[C@@]23OO4 |
|
| MolPort-020-005-671 |
0.61 |
C[C@@H]1CC[C@H]2[C@@H](C)C(O)O[C@@H]3OC[C@]4(C)C[C@@H]1[C@@]23OO4 |
|
| MolPort-039-142-119 |
0.61 |
CC1CCC2C(C)C(O)OC3OCC4(C)CC1C23OO4 |
|
| MolPort-035-669-080 |
0.61 |
COc1ccc(cc1)N1CCN(CC1)C(=O)CCC(=O)O[C@@H]1O[C@@H]2O[C@]3(C)CCC4[C@H](C)CCC([C@H]1C)[C@@]24OO3 |
|
| MolPort-035-669-077 |
0.61 |
C[C@@H]1CCC2[C@@H](C)[C@H](OC(=O)CCC(=O)N3CCN(CC3)c3ccccc3F)O[C@@H]3O[C@]4(C)CCC1[C@@]23OO4 |
|
| MCULE-8833924827 |
0.61 |
OC1[C@H](C)[C@@]2([H])[C@]34[C@@]([C@@H](CC2)C)([H])C[C@](CO[C@@]3([H])O1)(C)OO4 |
|
| MCULE-5827812878 |
0.61 |
C123C4C(C)CCC1C(C)C(OC2OC(CC4)(C)OO3)OC(CCC(=O)N1CCN(CC1)C1C=CC(=CC=1)OC)=O |
|
| MCULE-7682458089 |
0.61 |
C123[C@]4([H])[C@H](C)CCC1([H])C([H])(C)C(O[C@@]2([H])OC(CC4)(C)OO3)([H])OC(CCC(=O)NC(CC(C)C)C(=O)NC(CS)C(O)=O)=O |
|
| MCULE-2598244276 |
0.61 |
[C@]123[C@]4([H])[C@H](C)CC[C@@]1([H])[C@@]([H])(C)[C@](O[C@]2([H])OC(CC4)(C)OO3)([H])OC(CCC(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CS)C(O)=O)=O |
|
| MCULE-8713696515 |
0.61 |
C123C4C(C)CCC1C(C)C(OC2OC(CC4)(C)OO3)OC(CCC(=O)N1CCN(CC1)C1=CC=CC=C1F)=O |
|
| MolPort-000-803-468 |
0.60 |
C[C@@H]1CCC2C(C)C(OC(=O)CCC(=O)NCCCC(=O)ON3C(=O)CCC3=O)O[C@H]3OC4(C)CC[C@@H]1C23OO4 |
|
| MCULE-7213253598 |
0.60 |
C123[C@]4([H])[C@H](C)CCC1([H])C([H])(C)C(O[C@@]2([H])OC(CC4)(C)OO3)([H])OC(CCC(NCCCC(=O)ON1C(=O)CCC1=O)=O)=O |
|
| MCULE-3007302423 |
0.60 |
[C@]123[C@]4([H])[C@H](C)CC[C@@]1([H])[C@@]([H])(C)[C@](O[C@]2([H])OC(CC4)(C)OO3)([H])OC(CCC(=O)N[C@@H](CC(C)C)C(NCCC1C=CC(=CC=1)O)=O)=O |
|
| MCULE-4426764844 |
0.60 |
C123[C@]4([H])[C@H](C)CCC1([H])C([H])(C)C(O[C@@]2([H])OC(CC4)(C)OO3)([H])OC(CCC(=O)NC(CC(C)C)C(NCCC1C=CC(=CC=1)O)=O)=O |
|
