SANC00371 11-Hydroxy-19-(3-methylbuten-3-oyloxy)-abieta-5,7,9(11),13-tetraene-12-one




Analog ID Simularity score SMILES

Selection options

Mcule | MolPort | All | None
MolPort-001-740-445 0.78 COC(=O)[C@]1(C)CC[C@]2(C)CC[C@]3(C)C4=CC=C5C(C)=C(O)C(=O)C=C5[C@]4(C)CC[C@@]3(C)[C@@H]2C1
MolPort-035-691-407 0.78 COC(=O)[C@@]1(C)CC[C@]2(C)CC[C@]3(C)C4=CC=C5C(C)=C(O)C(=O)C=C5[C@]4(C)CC[C@@]3(C)[C@@H]2C1
MolPort-023-276-913 0.78 COC(=O)[C@]1(C)CC[C@]2(C)CCC3(C)C4=CC=C5C(C)=C(O)C(=O)C=C5[C@]4(C)CC[C@@]3(C)[C@@H]2C1
MolPort-009-019-603 0.78 COC(=O)[C@]1(C)CC[C@]2(C)CC[C@]3(C)C4=CC=C5C(C)=C(O)C(=O)C=C5[C@]4(C)CC[C@@]3(C)C2C1
MolPort-035-944-124 0.78 COC(=O)C1(C)CCC2(C)CCC3(C)C4=CC=C5C(C)=C(O)C(=O)C=C5C4(C)CCC3(C)C2C1
MCULE-3267208105 0.78 [C@]12(C)CC[C@@]3(C)CC[C@@](C)(C(=O)OC)C[C@@]3([H])[C@]1(C)CC[C@@]1(C)C3=CC(C(O)=C(C)C3=CC=C21)=O
MCULE-7690305542 0.78 C1(=O)C=C2[C@]3(C)CC[C@@]4(C)[C@]5([H])C[C@](C)(C(=O)OC)CC[C@]5(C)CC[C@]4(C)C3=CC=C2C(C)=C1O
MCULE-4608225014 0.78 C[C@]12CC[C@](C)(C(=O)OC)C[C@H]1[C@@]1(C)CC[C@]3(C4=CC(=O)C(O)=C(C)C4=CC=C3[C@]1(C)CC2)C
MCULE-2007080805 0.78 CC1C2=CC=C3C4(C)CCC5(C)CCC(C(OC)=O)(C)CC5C4(C)CCC3(C)C2=CC(=O)C=1O
MCULE-9550512667 0.72 C1[C@](C(=O)O)(C)CC[C@]2(CC[C@]3(C4=CC=C5C(C)=C(O)C(=O)C=C5[C@@]4(C)CC[C@]3(C)[C@@]12[H])C)C
MCULE-6960695081 0.72 C1(=O)C=C2[C@]3(C)CC[C@@]4(C)[C@]5([H])C[C@](C)(C(=O)O)CC[C@]5(C)CC[C@]4(C)C3=CC=C2C(C)=C1O
MCULE-4091889789 0.72 C12=CC(=O)C(=C(C)C1=CC=C1C3(C(C)(C4C(CC3)(C)CCC(C)(C(O)=O)C4)CCC21C)C)O
MCULE-3609209994 0.72 C1[C@]2([H])[C@@](C)(CC[C@@]3(C)[C@@]2(C)CC[C@]2(C)C3=CC=C3C2=CC(=O)C(O)=C3C)CC[C@]1(C(O)=O)C
MCULE-2393938301 0.72 CC1C2C([C@]3(C(=CC=2)[C@@]2([C@@]([C@]4([C@](CC2)(C)CC[C@@](C(=O)O)(C)C4)[H])(C)CC3)C)C)=CC(=O)C=1O
MolPort-003-665-482 0.72 CC1=C(O)C(=O)C=C2C1=CC=C1[C@@]2(C)CC[C@@]2(C)[C@@H]3C[C@@](C)(CC[C@]3(C)CC[C@]12C)C(O)=O
MolPort-023-276-694 0.72 CC1=C(O)C(=O)C=C2C1=CC=C1[C@@]2(C)CC[C@@]2(C)[C@@H]3C[C@@](C)(CC[C@]3(C)CCC12C)C(O)=O
MolPort-035-691-406 0.72 CC1=C(O)C(=O)C=C2C1=CC=C1[C@@]2(C)CC[C@@]2(C)[C@@H]3C[C@](C)(CC[C@]3(C)CC[C@]12C)C(O)=O
MolPort-046-762-911 0.72 CC1=C(O)C(=O)C=C2C1=CC=C1[C@@]2(C)CCC2(C)[C@H]3C[C@](C)(CC[C@]3(C)CC[C@]12C)C(O)=O
MCULE-5727228686 0.70 C(C)(=O)OC1CCC2(C)C(C1)=CC=C1C3CCC(C(C)C=CC(C)C(C)C)C3(C)CC=C12
MolPort-046-689-240 0.68 CC[C@H](C)C(=O)O[C@H]1C[C@@H](C)C=C2C=C[C@H](C)[C@H](CC[C@@H]3CC=CC(=O)O3)[C@@H]12
MolPort-046-762-840 0.68 CC[C@H](C)C(=O)O[C@@H]1C[C@H](C)C=C2C=C[C@H](C)[C@H](CC[C@@H]3CC=CC(=O)O3)[C@@H]12
MolPort-046-689-254 0.68 CCC(C)(C)C(=O)O[C@H]1C[C@@H](C)C=C2C=C[C@H](C)[C@H](CC[C@@H]3CC=CC(=O)O3)[C@@H]12
MCULE-8441428825 0.67 C[C@]12C=CC3[C@](CCC4C=3CCC(=O)C=4)([H])[C@]1([H])CC[C@@H]2OC(=O)C
MCULE-4085006103 0.67 C12C=C[C@]3(C(CC[C@@H]3OC(C)=O)C1CCC1=CC(=O)CCC=21)C
MCULE-7686328610 0.67 C12CCC3(C)C(CCC3C1C=CC1=CC(C=CC21C)=O)OC(=O)C
MCULE-2678037862 0.67 [C@]12(C)CC[C@]3([C@@]([H])(CC[C@]4([H])CC(=O)CC[C@]34C)C1=CC=C2C1COC(=O)C=1)[H]
MolPort-039-338-853 0.67 CC([C@H]1CC[C@@]2(C)C3=C(CC[C@]12C)C=C1C=CC(=O)OC(C)(C)[C@@H]1CC3)C1CC=C(C)C(=O)O1
MolPort-002-529-686 0.67 CC(=O)O[C@H]1CCC2C3CCC4=CC(=O)CCC4=C3C=C[C@]12C
MolPort-004-964-577 0.67 CC(=O)O[C@H]1CC[C@H]2[C@@H]3CCC4=CC(=O)CCC4=C3C=C[C@]12C
MolPort-002-911-111 0.67 CC(=O)OC1CCC2C3C=CC4=CC(=O)C=CC4(C)C3CCC12C
MolPort-046-596-771 0.67 CC12CC[C@H]3C(CCC4CC(=O)CCC34C)C1=CC=C2C1=CC(=O)OC1
MolPort-002-517-213 0.67 C[C@]12CC[C@H]3[C@@H](CC[C@@H]4CC(=O)CC[C@]34C)C1=CC=C2C1=CC(=O)OC1
MolPort-002-529-354 0.66 CC(=O)O[C@@]1(CC[C@H]2[C@@H]3C=CC4=CC(=O)C=C[C@]4(C)[C@H]3CC[C@]12C)C(C)=O
MolPort-000-703-777 0.66 CC(=O)O[C@@]1(CCC2C3C=CC4=CC(=O)C=CC4(C)C3CCC12C)C(C)=O
MolPort-046-765-304 0.66 CC(=O)OC1(CC[C@H]2[C@@H]3C=C(C)C4=CC(=O)C(C)=C[C@]4(C)[C@H]3CC[C@]12C)C(C)=O
MolPort-046-596-262 0.66 CC(=O)O[C@@]1(CCC2C3C=CC4=CC(=O)C=C[C@]4(C)C3CC[C@]12C)C(C)=O
MolPort-002-513-611 0.66 CC1=CCC[C@]2(C)C[C@H]3OC(=O)C(=C)[C@H]3C=C12
MolPort-002-517-202 0.66 CC(=O)O[C@H]1CC[C@@]2(C)[C@H](CC[C@@H]3[C@@H]2CC[C@@]2(C)C3=CC=C2C2=CC(=O)OC2)C1
MolPort-046-596-765 0.66 CC(=O)OC1CC[C@@]2(C)C(CCC3[C@@H]2CC[C@@]2(C)C3=CC=C2C2=CC(=O)OC2)C1
MolPort-002-525-323 0.66 C[C@]12CCC3[C@@H](CCC4C[C@@H](O)CC[C@]34C)C1=CC=C2C1=CC(=O)OC1
MolPort-039-338-481 0.66 CC1=C2C=C3CC[C@@H]4C(C)(C)CCC[C@@]4(C)[C@@H]3C[C@H]2OC1=O
MCULE-4631476452 0.66 [C@]12(C)CC[C@]3([C@@]([H])(C=CC4=CC(=O)C=C[C@]34C)[C@]1([H])CC[C@@]2(C(C)=O)OC(C)=O)[H]
MCULE-4598208373 0.66 C12(C)CCC3C(C=CC4=CC(=O)C=CC34C)C1CC[C@@]2(C(C)=O)OC(C)=O
MCULE-4844058467 0.66 [C@]12(C)CCC3[C@@]([H])(CCC4C[C@@H](O)CC[C@]34C)C1=CC=C2C1COC(=O)C=1
MCULE-5110860846 0.66 [C@]12(C)CC[C@]3([C@@]([H])(CC[C@]4([H])C[C@H](CC[C@]34C)OC(C)=O)C1=CC=C2C1COC(=O)C=1)[H]
MCULE-7195812349 0.65 [C@]12(C)CC[C@]3([C@@]([H])(CC=C4C[C@H](CC[C@]34C)OC(C)=O)C1=CC=C2C(C)=O)[H]
MCULE-1975394311 0.65 C12(C)CCC3C(CC=C4CC(CCC34C)OC(C)=O)C1=CC=C2C(C)=O
MolPort-002-528-928 0.65 CC(=O)O[C@H]1CC[C@]2(C)[C@H]3CC[C@@]4(C)C(=CC=C4C(C)=O)[C@@H]3CC=C2C1
MolPort-046-596-572 0.65 CC(=O)OC1CC[C@]2(C)C3CC[C@@]4(C)C(=CC=C4C(C)=O)C3CC=C2C1
MolPort-039-338-289 0.64 C[C@@]1(CO)[C@H](O)CC[C@@]2(C)[C@H](CC(C3OC(=O)C(\C=C\[C@@H]4C(=C)CC[C@@H]5[C@](C)(CO)[C@H](O)CC[C@@]45C)=C3)C3=CCOC3=O)C(=C)CC[C@H]12
MCULE-3655756453 0.64 [C@@H]1(/C=C(\C)/C(O)=O)CC[C@@H](C)[C@@]2([H])[C@@H](CC(=C21)C)OC(C)=O
MCULE-9779909061 0.64 O=C1C(=C)[C@@]2(CCC(=C3[C@@]([H])([C@@]2([H])O1)C(C)=CC3=O)C)[H]
MolPort-039-338-125 0.64 C[C@H](CC\C=C(/C)C(O)=O)[C@H]1C[C@H](OC(C)=O)[C@@]2(C)C3=CCC4C(C)(C)[C@@H](O)CC[C@]4(C)C3=CC[C@]12C
MolPort-001-742-274 0.64 C[C@@H]1CC[C@@H](\C=C(/C)C(O)=O)C2=C(C)C[C@@H](OC(C)=O)[C@H]12
MolPort-039-338-749 0.63 CC1=CCC(OC1=O)C(C)(O)[C@H]1CC[C@@]2(C)C3=C(CC[C@]12C)C=C1C=CC(=O)OC(C)(C)[C@@H]1CC3
MolPort-039-338-189 0.63 CC(COC(C)=O)C1=C(O)C(=O)C2=C([C@@H](C[C@H]3C(C)(C)CCC[C@]23C)OC(C)=O)C1=O
MCULE-3919802292 0.63 [C@]12(C)CC(C(OC)=O)C3C(CCC4=CC(=O)C=C[C@]34C)C1CC=C2C(=O)COC(C)=O
MCULE-2768288313 0.63 C1(=O)C=C2[C@](C)(C=C1)C1[C@]([H])([C@@]3([H])[C@@](CC=1)(C)C(C(=O)COC(C)=O)=CC3)CC2
MCULE-8068988767 0.63 C[C@]12CC=C3[C@](CCC4[C@]3(C)C=CC(=O)C=4)([H])[C@]1([H])CC=C2C(=O)COC(=O)C
MolPort-039-338-837 0.63 C[C@H](CC\C=C(/C)C(O)=O)[C@H]1C[C@H](OC(C)=O)[C@@]2(C)C3=CCC4C(C)(C)C(=O)CC[C@]4(C)C3=CC[C@]12C
MolPort-002-509-382 0.63 COC(=O)C1C[C@@]2(C)C(CC=C2C(=O)COC(C)=O)C2CCC3=CC(=O)C=C[C@]3(C)C12
MolPort-006-127-472 0.63 CC(=O)OCC(=O)C1=CC[C@H]2[C@@H]3CCC4=CC(=O)C=C[C@]4(C)C3=CC[C@]12C
MolPort-046-762-598 0.63 CC(=O)OCC(=O)C1=CC[C@@H]2[C@@H]3CCC4=CC(=O)C=C[C@]4(C)C3=CC[C@]12C
MolPort-046-158-328 0.63 CC(=O)OCC(=O)C1=CCC2C3CCC4=CC(=O)C=C[C@]4(C)C3=CC[C@]12C
MolPort-035-705-837 0.63 CCO[C@@H]1[C@@H](O)[C@H]2C(C)(C)CCC[C@]2(C)C2=C1C(=O)C(C(C)COC(C)=O)=C(O)C2=O
MolPort-027-720-911 0.63 CCCC[C@@H]1OC(=O)C2=C1CCC=C2
MolPort-039-052-280 0.63 CCCCC1OC(=O)C2=C1CCC=C2
MolPort-035-705-836 0.62 CC(COC(C)=O)C1=C(O)C(=O)C2=C([C@H](O)[C@@H](O)[C@H]3C(C)(C)CCC[C@]23C)C1=O
MolPort-002-530-359 0.62 CCCCCCCC[C@H]1CC[C@H]2[C@@H]3CC=C4C[C@H](CC[C@]4(C)[C@H]3CC[C@]12C)OC(=O)C(\C)=C/C
MolPort-027-836-920 0.62 C[C@]12CC=C3[C@@H](C=CC4=CC(=O)CC[C@]34C)[C@@H]1CC[C@@]21CCC(=O)O1
MolPort-042-646-608 0.62 CCCCCCCCC1CCC2C3CC=C4C[C@H](CC[C@]4(C)C3CC[C@]12C)OC(=O)C(\C)=C/C
MolPort-046-765-409 0.62 C[C@]12CC=C3[C@@H](C=CC4=CC(=O)CC[C@]34C)[C@H]1CC[C@@]21CCC(=O)O1
MolPort-003-712-637 0.62 C\C=C(/C)C(=O)OC1CCC2(C)C3CCC4(C)C(CCC4C3CC=C2C1)C(C)CCCC(C)C
MolPort-003-855-493 0.62 CCCCCCCCC1CCC2C3CC=C4CC(CCC4(C)C3CCC12C)OC(=O)C(\C)=C/C
MolPort-039-052-387 0.62 C[C@H]1C[C@@H]2OC(=O)C(=C)[C@H]2CC=C1\C=C\C(C)=O
MolPort-003-846-182 0.62 [Na+].CC[C@H](C)C(=O)O[C@H]1C[C@@H](C)C=C2C=C[C@H](C)[C@H](CC[C@H](O)C\C=C\C([O-])=O)[C@@H]12
MolPort-044-831-066 0.62 C[C@H]1C[C@@H]2OC(=O)C(=C)C2CC=C1\C=C\C(C)=O
MolPort-003-846-187 0.62 [Na+].CCC(C)(C)C(=O)O[C@H]1C[C@@H](C)C=C2C=C[C@H](C)[C@H](CC[C@H](O)C\C=C\C([O-])=O)[C@@H]12
MCULE-8952317949 0.62 CCCC[C@H]1C2=C(C=CCC2)C(=O)O1
MCULE-9958013133 0.62 C1CC2C(CCCC)OC(=O)C=2C=C1
MCULE-3605854604 0.62 C12(C)CCC3C(CC=C4CC(CCC34C)OC(=O)C(C)=C([H])C)C1CCC2C(C)CCCC(C)C
MCULE-3193343372 0.62 C12(C)CCC(CC1=CCC1C2CCC2(C1CCC2CCCCCCCC)C)OC(=O)C(C)=CC
MCULE-7272779592 0.62 [C@]12(C)CC[C@@H](CC1=CC[C@]1([H])[C@]2([H])CC[C@]2([C@@]1([H])CC[C@@H]2CCCCCCCC)C)OC(=O)C(C)=CC
MCULE-9966402057 0.62 C1=CC23CC(=O)OC2C=CC3C=C1
MCULE-6482288037 0.62 C1CC2(C)C3CCC4(C)C(C(CCCC(C)C)C)CCC4C3CC=C2CC1OC(=O)C=CCC(C)C
MCULE-2528413632 0.62 CC1C(C=CC(C)=O)=CCC2C(C(OC2C1)=O)=C
MCULE-4810985269 0.62 [C@@]12([H])OC(=O)C([C@@]1([H])CC=C(/C=C/C(=O)C)[C@@H](C)C2)=C
MCULE-9024401259 0.62 C12(C)CCC(CC1=CCC1C2CCC2(C1CCC2CCCCCCCC)C)OC(=O)C=CC
MCULE-4343790137 0.62 C12(C)CCC3C(CC=C4CC(CCC34C)OC(=O)C([H])=C([H])C)C1CCC2C(C)CCCC(C)C
MCULE-8493622164 0.62 [C@]12(C)CC[C@@H](CC1=CC[C@]1([H])[C@]2([H])CC[C@]2([C@@]1([H])CC[C@@H]2CCCCCCCC)C)OC(=O)C=CC
MCULE-4058521866 0.62 C1=CC2[C@@](C[C@@](O)(C(CO)=C)C(=O)C=2)(C)[C@@H](C)[C@H]1OC(=O)/C=C/C=C/[C@H](C)CC
MCULE-1909780355 0.62 [C@]12(C)CC[C@@H](CC1=CCC1C2CC[C@]2(C1CCC2CCCCCCCC)C)OC(=O)C(C)=C(C)Cl
MCULE-2150444872 0.62 C12=CC[C@]3(C(CC=C3C(=O)COC(C)=O)[C@]1([H])CCC1=CC(=O)CC[C@]21C)C
MCULE-8995686119 0.62 C12(C)CCC3C(CC=C4CC(CCC34C)OC(=O)C(C)=C(C)Cl)C1CCC2C(C)CCCC(C)C
MCULE-2782751278 0.62 [C@]12(C)CCC3C(CC=C4C[C@H](CC[C@]34C)OC(=O)C(C)=C(C)Cl)C1CC[C@]2([H])[C@H](C)CCCC(C)C
MolPort-003-855-527 0.62 CCCCCCCCC1CCC2C3CC=C4CC(CCC4(C)C3CCC12C)OC(=O)\C=C\C
MolPort-002-530-454 0.62 CCCCCCCC[C@H]1CC[C@H]2[C@@H]3CC=C4C[C@H](CC[C@]4(C)[C@H]3CC[C@]12C)OC(=O)\C=C\C
MolPort-003-702-338 0.62 C\C=C\C(=O)OC1CCC2(C)C3CCC4(C)C(CCC4C3CC=C2C1)C(C)CCCC(C)C
MolPort-046-697-234 0.62 CC[C@@H](C)\C=C\C=C\C(=O)O[C@H]1C=CC2=CC(=O)[C@@](O)(C[C@]2(C)[C@H]1C)C(=C)CO
MolPort-046-793-005 0.62 CCCCCC\C=C/CCCCCCCC(=O)O[C@H]1CC[C@]2(C)[C@H]3CC[C@]4(C)[C@H](CC[C@H]4C3=CC=C2C1)[C@H](C)CCCC(C)C
MolPort-046-793-004 0.62 CCCCCCCC\C=C/CCCCCCCC(=O)O[C@H]1CC[C@]2(C)[C@H]3CC[C@]4(C)[C@H](CC[C@H]4C3=CC=C2C1)[C@H](C)CCCC(C)C
MolPort-042-646-609 0.62 CCCCCCCCC1CCC2C3CC=C4C[C@H](CC[C@]4(C)C3CC[C@]12C)OC(=O)C(\C)=C(\C)Cl
MolPort-002-509-815 0.62 CC(=O)OCC(=O)C1=CCC2[C@@H]3CCC4=CC(=O)CC[C@]4(C)C3=CC[C@]12C
MolPort-007-549-283 0.62 CC(C)CCCC(C)C1CCC2C3CC=C4CC(CCC4(C)C3CCC12C)OC(=O)C(\C)=C(\C)Cl
MolPort-009-649-142 0.62 CC(C)CCC[C@@H](C)[C@H]1CCC2C3CC=C4C[C@H](CC[C@]4(C)C3CC[C@]12C)OC(=O)C(\C)=C(/C)Cl
MolPort-046-597-601 0.62 CC(C)CCCC(C)C1CCC2C3CC=C4C[C@H](CC[C@]4(C)C3CC[C@]12C)OC(=O)C(\C)=C(/C)Cl
MolPort-006-114-296 0.62 CC(C)[C@@H](C)\C=C\[C@@H](C)[C@H]1CC[C@H]2C3=CC=C4C[C@H](CC[C@]4(C)[C@H]3CC[C@]12C)OC(C)=O
MolPort-046-418-658 0.61 CC1=CCC2=C(C)CC[C@@H]3[C@H](OC(=O)C3=C)[C@@H]12
MolPort-046-689-247 0.61 CC(=O)OCC(=O)[C@@]1(O)CC[C@H]2[C@@H]3C=CC4=CC(=O)C=C[C@]4(C)[C@H]3[C@@H](O)C[C@]12C
MolPort-002-526-956 0.61 C\C=C(\C)C(=O)O[C@H]1CC(C)=C2[C@@H]([C@H]3OC(=O)[C@H](C)[C@H]13)C(C)=CC2=O
MolPort-009-649-073 0.61 CC(C)CCC[C@@H](C)[C@H]1CCC2C3CC=C4C[C@H](CC[C@]4(C)C3CC[C@]12C)OC(=O)\C=C(/C)Cl
MolPort-002-512-251 0.61 COC(=O)[C@@]1(C)CC[C@]2(C)CC[C@]3(C)C(=CC(=O)C4[C@@]5(C)CC[C@H](OC(C)=O)C(C)(C)C5CC[C@@]34C)C2=C1
MolPort-042-646-607 0.61 CC(C)CCCC(C)C1CCC2C3CC=C4C[C@H](CC[C@]4(C)C3CC[C@]12C)OC(=O)\C=C(/C)Cl
MCULE-3762294950 0.61 [C@]12(C)CCC3C(CC=C4C[C@H](CC[C@]34C)OC(=O)C=C(C)Cl)C1CCC2C(C)CCCC(C)C
MCULE-8873828930 0.61 C1=CC2(C)CCC3C(=C)C(=O)OC3C2=C(C)C1=O
MCULE-4781798555 0.61 [C@]12(C)C=CC(C=C1[C@H](C[C@@]1([H])C3[C@@](C)(C(=CC3)C(=O)COC(C)=O)C[C@H](O)C21)C)=O
MolPort-046-158-543 0.61 CC1(C)CCC[C@]2(C)[C@H]3COC(=O)C3=CC[C@@H]12
MolPort-044-811-226 0.61 CC1=C(O)C(=O)C=C2C1=CC=C1[C@@]2(C)CC[C@@]2(C)[C@@H]3C[C@@](C)(CC[C@]3(C)CC[C@]12C)N=C=O
MolPort-002-525-175 0.61 C[C@H]1C[C@H]2C3CC=C(C(=O)COC(C)=O)[C@@]3(C)C[C@H](O)C2[C@@]2(C)C=CC(=O)C=C12
MolPort-035-705-835 0.60 CC(COC(C)=O)C1=C(O)C(=O)C2=C([C@H](OC(C)=O)[C@@H](O)[C@H]3C(C)(C)CCC[C@]23C)C1=O
MolPort-002-528-190 0.60 CCCCCCCCC1CCC2C3CC=C4C[C@@H](CC[C@@]4(C)C3CC[C@@]12C)OC(=O)C(\C)=C(/C)C(=O)O[C@H]1CC[C@]2(C)[C@H]3CC[C@]4(C)[C@@H](CCCCCCCC)CC[C@H]4[C@@H]3CC=C2C1
MolPort-046-153-043 0.60 CC1CCC\C=C\C\C=C/C(OC(=O)\C=C/C=C/C=C/C(O)=O)\C=C\C(=O)O1
MolPort-000-775-527 0.60 CCCCCCCCC1CCC2C3CC=C4C[C@H](CC[C@]4(C)C3CC[C@]12C)OC(=O)C(\C)=C(/C)C(=O)O[C@@H]1CC[C@@]2(C)C3CC[C@@]4(C)C(CCCCCCCC)CCC4C3CC=C2C1
MolPort-042-675-333 0.60 CCC\C=C\C=C\C(=O)O[C@@H]1C[C@H]2[C@@H](\C=C(C)\C(=O)[C@]3(C[C@@H](C)[C@H](O)[C@@H]3\C=C1/C)OC(C)=O)C2(C)C
MolPort-046-426-259 0.60 C\C(\C=C\C12OC1(C)CCCC2(C)C)=C/C=C/C(/C)=C\C(O)=O
MolPort-006-393-960 0.60 C\C(\C=C\C12OC1(C)CCCC2(C)C)=C/C=C/C(/C)=C/C(O)=O
MolPort-000-826-397 0.60 CC(=O)OCC(=O)C1=CCC2C3CCC4=CC(=O)C=CC4(C)C3C(CC12C)OC(C)=O
MolPort-046-765-473 0.60 [2H]C([2H])([2H])C(=O)O[C@]1(C(C)=O)C(=C)C[C@H]2[C@@H]3C=C(C)C4=CC(=O)CC[C@]4(C)[C@H]3CC[C@]12C
MolPort-003-930-509 0.60 CC(=O)O[C@]1(C(C)=O)C(=C)C[C@H]2[C@@H]3C=C(C)C4=CC(=O)CC[C@]4(C)[C@H]3CC[C@]12C
MolPort-044-811-241 0.60 CCCCCOC(=O)N[C@]1(C)CC[C@]2(C)CC[C@]3(C)C4=CC=C5C(C)=C(O)C(=O)C=C5[C@]4(C)CC[C@@]3(C)[C@@H]2C1
MolPort-046-596-430 0.60 CC(=O)OCC(=O)C1=CCC2C3CCC4=CC(=O)C=C[C@]4(C)C3C(C[C@]12C)OC(C)=O
MolPort-005-944-312 0.60 CC1C\C=C\C=C\CCC(O)CCC\C=C\C(=O)O1
MolPort-002-527-583 0.60 CC(=O)OCC(=O)C1=CC[C@H]2[C@@H]3CCC4=CC(=O)C=C[C@]4(C)[C@H]3[C@H](C[C@]12C)OC(C)=O
MCULE-1077978348 0.60 [C@]12(C)CC[C@@H](CC1=CCC1C2CC[C@]2(C1CCC2CCCCCCCC)C)OC(=O)C(C)=C(C)C(=O)O[C@@H]1CC[C@@]2(C(=CCC3C2CC[C@@]2(C3CCC2CCCCCCCC)C)C1)C
MCULE-8645812725 0.60 C1CCC=CCC=CC(C=CC(OC1C)=O)OC(=O)/C=C\C=C\C=C\C(O)=O
MCULE-2358670355 0.60 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-4909295164 0.60 C12C(OC(C)=O)CC3C(CCCC3(C)C)C=1C(C(O)=C(C(C)C)C2=O)=O
MCULE-9841786738 0.60 [C@@]12([H])C=C(C)[C@H](OC(/C=C/C=C/CCC)=O)C[C@@H]3C(C)(C)[C@@H]3C=C(C)C(=O)[C@@]1(OC(C)=O)C[C@@H](C)[C@@H]2O
MCULE-6997832079 0.60 C12(C)CC(OC(C)=O)C3C(CCC4=CC(=O)C=CC34C)C1CC=C2C(=O)COC(C)=O
MCULE-3036206485 0.60 C1CCC=CC=CCC(C)OC(=O)C=CCC(O)C1
MCULE-1131719628 0.60 [C@]12(C)C[C@H](OC(C)=O)[C@]3([C@@]([H])(CCC4=CC(=O)C=C[C@]34C)[C@]1([H])CC=C2C(=O)COC(C)=O)[H]
MCULE-4385148400 0.60 OCC1=CC(C2=C(C)CC[C@H]3C(=C)C(=O)O[C@@H]3[C@]21[H])=O
MCULE-2441734480 0.60 O=C1CCC2(C)C3CCC4(C)C(C(=C)CC4C3C=C(OC)C2=C1)(OC(C)=O)C(C)=O
MCULE-9261087245 0.60 C([C@]1(C2CCC([C@H]([C@@]2(CC[C@H]1OC(CCC(=O)O)=O)C)C=CC1C(OCC=1)=O)=C)C)OC(CCC(=O)O)=O
MCULE-8506049488 0.60 C1(/C=C/[C@@H]2C(=C)CC[C@]3([H])[C@](C)(COC(=O)CCC(=O)O)[C@@H](CC[C@@]23C)OC(=O)CCC(=O)O)C(=O)OCC=1
MCULE-2135650397 0.60 O=C(CCC(O[C@H]1[C@](COC(CCC(O)=O)=O)(C)[C@@H]2[C@@]([C@@H](C(CC2)=C)C=CC2C(=O)OCC=2)(C)CC1)=O)O
MCULE-5099900454 0.60 C12(C(/C=C/C3=CCOC3=O)C(=C)CCC1C(C)(COC(CCC([O-])=O)=O)C(OC(CCC(=O)O)=O)CC2)C
MCULE-1414577822 0.60 C12=CC(OC1=O)CC(C)=CC1OC(=O)C(=C)C1CCC(C)=CCC2
MCULE-1305866944 0.60 O1C2C(C3CCCC=3C1=O)CCCC2
MCULE-5162812783 0.60 C12C(C)=CC(=O)C1=C(C)CCC1C(C)C(=O)OC12
MCULE-2030478341 0.60 [C@]12([H])C(C)=CC(=O)C1=C(C)CC[C@H]1[C@@H](C(=O)O[C@H]21)C