SANC00174 D-Friedoolean-14-en-oic acid




Analog ID Similarity score SMILES

Selection options

Mcule | MolPort | All | None
MolPort-035-683-171 0.96 CC(=O)O[C@H]1CC[C@@]2(C)[C@@H](CC[C@]3(C)[C@@H]2CC=C2[C@@H]4CC(C)(C)CC[C@@]4(CC[C@@]32C)C(O)=O)C1(C)C
MolPort-039-052-417 0.96 C[C@@H]1CC[C@@]2(CC[C@]3(C)C(=CC[C@@H]4[C@@]5(C)CC[C@H](OC(C)=O)C(C)(C)[C@@H]5CC[C@@]34C)[C@@H]2[C@H]1C)C(O)=O
MolPort-035-683-186 0.96 C[C@@H]1CC[C@@]2(CC[C@]3(C)C(=CC[C@@H]4[C@@]5(C)CC[C@H](OC(C)=O)C(C)(C)C5CC[C@@]34C)[C@@H]2[C@H]1C)C(O)=O
MCULE-5998876996 0.96 O(C(C)=O)[C@H]1CC[C@@]2(C)[C@H](C1(C)C)CC[C@@]1(C)[C@]3(C)CC[C@@]4(C(=O)O)CCC(C)(C)C[C@H]4C3=CC[C@@H]12
MCULE-2403352810 0.96 C12=CC[C@]3([H])[C@@]4(C)CC[C@H](OC(C)=O)C(C)(C)[C@@]4(CC[C@@]3(C)[C@]1(C)CC[C@]1(CC[C@@H](C)[C@H](C)[C@@]21[H])C(O)=O)[H]
MCULE-2054566768 0.96 [C@@]12(C)CC[C@]3(CCC(C)(C)C[C@@]3([H])C1=CC[C@]1([H])[C@@]3([C@]([H])(C(C)(C)[C@H](CC3)OC(C)=O)CC[C@@]21C)C)C(O)=O
MolPort-001-742-502 0.94 COC(=O)C12CCC(C)C(C)C1C1=CCC3C4(C)CCC(OC(C)=O)C(C)(C)C4CCC3(C)C1(C)CC2
MolPort-046-592-361 0.94 COC(=O)[C@]12CCC(C)(C)C[C@H]1C1=CCC3[C@@]4(C)CC[C@H](OC(C)=O)C(C)(C)C4CC[C@@]3(C)[C@]1(C)CC2
MolPort-044-649-784 0.94 COC(=O)[C@]12CC[C@@H](C)[C@H](C)[C@H]1C1=CC[C@@H]3[C@@]4(C)CC[C@H](OC(C)=O)C(C)(C)[C@@H]4CC[C@@]3(C)[C@]1(C)CC2
MolPort-044-649-712 0.94 COC(=O)[C@]12CCC(C)(C)C[C@H]1C1=CC[C@@H]3[C@@]4(C)CC[C@H](OC(C)=O)C(C)(C)[C@@H]4CC[C@@]3(C)[C@]1(C)CC2
MCULE-1480805765 0.94 CCOC([C@H]1[C@H]2C=C[C@H](CC2)C1)=O
MCULE-1988011337 0.94 CC(OC([C@H]1[C@H]2C=C[C@H](CC2)C1)=O)C
MCULE-5029800865 0.94 CC(OC([C@H]1[C@H]2C=C[C@H](CC2)C1)=O)(C)C
MCULE-8247739375 0.94 C12=CCC3C(C)(CCC4C(C(OC(C)=O)CCC34C)(C)C)C1(C)CCC1(CCC(C)C(C)C21)C(OC)=O
MCULE-1316925332 0.94 CC(OC(C1C2C=CC(CC2)C1)=O)C
MCULE-9697672273 0.94 CC(OC(C1C2C=CC(CC2)C1)=O)(C)C
MCULE-3460278496 0.94 C12CCC(C=C1)CC2C(OCC)=O
MCULE-8772466243 0.93 C1CC23CCOC(=O)C2(CCCC3)CC=1
MCULE-8638278493 0.93 O=C(OC1(CCCCC1)C)C1CC2CC1C=C2
MCULE-9975844805 0.93 O=C(OC1(C2CC3CC(C2)CC1C3)C)C1CC2CC1C=C2
MolPort-044-559-905 0.92 C[C@@H]1CC[C@@]2(CC[C@]3(C)C(=CC[C@@H]4[C@@]5(C)CC[C@H](OC(=O)[C@]67CC[C@@H](C)[C@H](C)[C@H]6C6=CCC8[C@@]9(C)CCC(=O)C(C)(C)C9CC[C@@]8(C)[C@]6(C)CC7)C(C)(C)C5CC[C@@]34C)[C@@H]2[C@H]1C)C(O)=O
MolPort-002-841-866 0.92 CC(=O)OC1CCC2C3C=CC4C(C)(C)C(=O)CCC4(C)C3CCC12C
MCULE-9611860953 0.92 C(O)(=O)[C@]12[C@@](C3=CC[C@]4([H])[C@]5(C)C(CC[C@]4([C@@]3(CC1)C)C)C(C)(C)[C@@H](OC(=O)[C@]13[C@@](C4=CCC6[C@]7(C)C(CC[C@]6([C@@]4(CC1)C)C)C(C)(C)C(=O)CC7)([H])[C@@H](C)[C@H](C)CC3)CC5)([H])[C@@H](C)[C@H](C)CC2
MCULE-2039968402 0.92 C12(C)CCC(C(C)(C)C1C=CC1C3C(C)(C(CC3)OC(C)=O)CCC21)=O
MCULE-9723128082 0.91 C12CC(C=C1)CC2C(OC1(C)CCCC1)=O
MCULE-1470831787 0.91 C1C[C@]2(C)C3C(=O)C=C4[C@]5([H])CC(C)(C)CC[C@]5(C(=O)O)CC[C@@]4(C)[C@]3(C)CCC2C(C)(C)[C@H]1OC(=O)C
MCULE-8924549531 0.91 C1C[C@]2(C)C3CC[C@]4(C)[C@@]([H])([C@H](C(O)=O)CCC(=C)C(C)C)[C@H](O)C[C@@]4(C)C=3CC[C@@]2([H])C(C)(C)[C@H]1OC(C)=O
MCULE-8274191901 0.91 [C@@]12(C)C[C@H]([C@]([H])([C@H](C(=O)O)CCC(=C)C(C)C)[C@@]1(C)CCC1[C@@]3(C)CC[C@H](OC(=O)C)C(C)(C)[C@]3([H])CCC2=1)O
MolPort-019-937-545 0.91 CC(=O)O[C@H]1CC[C@@]2(C)C(CC[C@]3(C)C2C(=O)C=C2[C@@H]4CC(C)(C)CC[C@@]4(CC[C@@]32C)C(O)=O)C1(C)C
MolPort-044-649-707 0.91 CC(=O)O[C@H]1CC[C@@]2(C)[C@@H](CC[C@]3(C)[C@@H]2C(=O)C=C2[C@@H]4CC(C)(C)CC[C@@]4(CC[C@@]32C)C(O)=O)C1(C)C
MolPort-044-649-591 0.91 C[C@@H]1CC[C@@]2(CC[C@]3(C)C(=CC(=O)[C@@H]4[C@@]5(C)CC[C@H](OC(C)=O)C(C)(C)[C@@H]5CC[C@@]34C)[C@@H]2[C@H]1C)C(O)=O
MolPort-044-562-376 0.91 CC(C)=CCC[C@H]([C@H]1[C@H](O)C[C@@]2(C)C3=C(CC[C@]12C)[C@@]1(C)CC[C@H](OC(C)=O)C(C)(C)C1CC3)C(O)=O
MolPort-006-069-345 0.91 CC(C)C(=C)CC[C@H]([C@H]1[C@H](O)C[C@@]2(C)C3=C(CC[C@]12C)[C@@]1(C)CC[C@H](OC(C)=O)C(C)(C)[C@@H]1CC3)C(O)=O
MolPort-039-339-016 0.90 CC(C)=CCC[C@H]([C@H]1CC[C@@]2(C)C3=C(CC[C@]12C)[C@@]1(C)CC[C@H](OC(C)=O)C(C)(C)[C@@H]1CC3)C(O)=O
MolPort-044-637-463 0.90 CC(C)=CCCC(C1CCC2(C)C3=C(CCC12C)C1(C)CCC(OC(C)=O)C(C)(C)C1CC3)C(O)=O
MolPort-035-706-385 0.90 CCCCCCCCCCCCCCCC(=O)O[C@H]1CC[C@@]2(C)[C@@H](CC[C@]3(C)[C@@H]2CC=C2[C@@H]4CC(C)(C)CC[C@]4(CO)CC[C@@]32C)C1(C)C
MCULE-9253743476 0.90 CC1([C@H](OC(=O)C)CC[C@@]2(C)[C@H]1CCC1[C@@]3(C)[C@]([C@@H]([C@H](C(=O)O)CC/C=C(/C)\C)CC3)(C)CCC=12)C
MCULE-5485844450 0.90 C1CC2(C)C3CCC4(C)C(C(CC/C=C(\C)/C)C(O)=O)CCC4(C)C=3CCC2C(C)(C)C1OC(=O)C
MolPort-027-835-567 0.89 O=C1OC(=O)[C@@H]2[C@H]1[C@@H]1CC[C@@H]2C=C1
MolPort-001-764-908 0.89 O=C1OC(=O)C2C1C1CCC2C=C1
MolPort-000-734-484 0.89 CC(C)C1=CC23CCC4C(C)(CCCC4(C)C(O)=O)C2CC1C1C3C(=O)OC1=O
MolPort-035-769-790 0.89 O=C1OC(=O)C2C1[C@H]1CC[C@@H]2C=C1
MolPort-002-516-481 0.89 CC(C)C1=CC23CCC4[C@](C)(CCC[C@@]4(C)C(O)=O)C2CC1[C@@H]1[C@H]3C(=O)OC1=O
MolPort-044-649-785 0.89 COC(=O)[C@]12CC[C@@H](C)[C@H](C)[C@H]1C1=CC(=O)[C@@H]3[C@@]4(C)CC[C@H](OC(C)=O)C(C)(C)[C@@H]4CC[C@@]3(C)[C@]1(C)CC2
MolPort-027-853-592 0.89 CC(=O)O[C@@H]1C[C@@]2(C)C(CC[C@]3(C)C2CC=C2C4CC(C)(C)CC[C@@]4(CC[C@@]32C)C(O)=O)C(C)(C)[C@H]1O
MCULE-1087443932 0.89 C1CC2C3C(=O)OC(=O)C3C3CCCCC3=C2CC1
MCULE-9103372368 0.89 C1(=O)C2C3CCC(C=C3)C2C(=O)O1
MCULE-8776636782 0.89 C1CC23C(=O)OC(=O)C2(CCCC3)CC=1
MCULE-5454494701 0.89 C123CCC4C(C)(CCCC4(C)C(O)=O)C1CC(C1C(OC(=O)C21)=O)C(C(C)C)=C3
MCULE-8868589151 0.89 C1(C)CC23CCCCC2(C(=O)OC3=O)CC=1
MCULE-2122490766 0.89 C1CC23CCCCC2(C(=O)OC3=O)C2CCCCC=12
MCULE-1252077735 0.89 C1CC23CC(=O)OC(=O)C2(CCCC3)CC=1
MCULE-5053755296 0.89 C1(C)CC23CCCCC2(C(=O)OC3=O)CC=1C
MCULE-6020138869 0.89 C1C2CC(CC2C(=O)OC(C)(C)C)C=1
MCULE-4463064740 0.89 C(OCC)(C1CC2CC1C=C2)=O
MCULE-2766753223 0.89 C(=O)(OC(C)C)C1CC2CC1C=C2
MCULE-3362275267 0.89 C1CC=CC2C(C(OCC)=O)C2CC1
MolPort-002-508-454 0.89 CCCOC(=O)C12CCC(C)(C)CC1C1=CCC3[C@@]4(C)CC(O)C(O)C(C)(C)C4CC[C@@]3(C)[C@@]1(C)CC2
MolPort-001-793-877 0.89 CCOC(=O)C1CC2CC1C=C2
MolPort-005-938-238 0.89 CC(C)(C)OC(=O)C1CC2CC1C=C2
MolPort-008-346-698 0.88 CC(CCC(O)=O)C1CC[C@@]2(C)C3=C(CC[C@]12C)[C@@]1(C)CCC(OC(C)=O)C(C)(C)C1CC3
MCULE-8982382729 0.88 C12[C@H](C)C[C@]3([C@@]([H])(CC[C@]4([H])C[C@@H](CC[C@]34C)OC(C)=O)[C@]1([H])CCC=2C(C)CCC(OC)=O)[H]
MCULE-6259050360 0.88 [C@@]12(C)CCC(C(C)CCC(O)=O)[C@@]1(C)CCC1[C@@]3(C(C(C)(C)C(CC3)OC(C)=O)CCC2=1)C
MCULE-4992964291 0.88 C1C2C3CC(CC(=O)C)C3C(C3([H])C(=O)OC(=O)C32[H])C=1
MCULE-5641241273 0.88 O=C1C2C3C=CC(CCCC3)C2C(=O)O1
MCULE-1124925533 0.88 C1(C)CC23CCCCCCCCCC2(C(=O)OC3=O)CC=1
MCULE-5491138764 0.88 C1(=O)C2C(C)C=C(CC2C(=O)O1)C
MCULE-5800803041 0.88 C1CCCC23C(=O)OC(=O)C2(CC=CC3)CCCCC1
MCULE-1244370752 0.88 C1(CC2CC1C=C2)C(OCCCCOC(C1CCC=CC1)=O)=O
MCULE-8016431488 0.88 C1C[C@]2(C)[C@@]3([H])CC=C4[C@]5([H])C[C@@]6(C(=O)O[C@@]([H])(C6)[C@]5(C)CC[C@@]4(C)[C@]3(C)CC[C@@]2([H])C(C)(C)[C@H]1O)C
MCULE-6412555386 0.88 [C@@]12(C)CC[C@@]3(C)[C@@]4([H])OC(=O)[C@@](C4)(C)C[C@@]3([H])C1=CC[C@]1([H])[C@@]3(C)CC[C@H](O)C(C)(C)[C@]3([H])CC[C@@]21C
MolPort-002-507-055 0.88 CC1C=C(C)C[C@H]2[C@@H]1C(=O)OC2=O
MolPort-000-797-000 0.88 CC1(C)CCCC2=C1CC1C(C2)C(=O)OC1=O
MolPort-000-829-812 0.88 CC1C=C(C)CC2C1C(=O)OC2=O
MolPort-020-005-756 0.88 C[C@]12C[C@H](OC1=O)[C@]1(C)CC[C@]3(C)C(=CC[C@@H]4[C@@]5(C)CC[C@H](O)C(C)(C)[C@@H]5CC[C@@]34C)[C@@H]1C2
MolPort-035-706-526 0.88 CC(=O)O[C@H]1CC[C@@]2(C)[C@@H](CC[C@]3(C)[C@@H]2CC=C2[C@@H]4C[C@@]5(C)C[C@H](OC5=O)[C@]4(C)CC[C@@]32C)C1(C)C
MCULE-6809736977 0.87 COC(C1C2C=CC(CC2)C1)=O
MCULE-4894937500 0.87 [H]C12C=CCCC1(C)C1CC(C3(C)C(C(C)CCC(OC)=O)CCC3C1CC2)OC(C)=O
MCULE-7442709707 0.87 C(C)(=O)OC1CCC2(C)C3C=CC4(C)C(C(C)CCC(OC)=O)CCC4C3CCC2C1
MCULE-7100298727 0.87 COC([C@H]1[C@H]2C=C[C@H](CC2)C1)=O
MCULE-9777116319 0.87 C1CC2(C(CCCC2)(CC=1)C(OC)=O)CCC(OC)=O
MolPort-035-706-457 0.87 CCCCCCCCCCCCCCCC(=O)O[C@H]1CC[C@@]2(C)[C@@H](CC[C@]3(C)[C@@H]2CC=C2[C@@H]4[C@@H](C)[C@H](C)CC[C@]4(C)CC[C@@]32C)C1(C)C
MolPort-035-706-392 0.87 COC(=O)[C@@]12CCC3=C(CC[C@@H]4[C@@]5(C)CC[C@H](O)C(C)(C)[C@@H]5CC[C@@]34C)[C@@H]1CC(C)(C)CC2
MolPort-028-754-123 0.87 CCCCCCCCCCCCCCCC(=O)O[C@H]1CC[C@@]2(C)[C@@H](CC[C@]3(C)[C@@H]2CC=C2[C@@H]4CC(C)(C)CC[C@]4(C)CC[C@@]32C)C1(C)C
MolPort-002-691-856 0.86 CC1=CC2C3C(C4C3C(=O)OC4=O)C1C1C2C(=O)OC1=O
MCULE-9683452020 0.86 C12C3C(C)=CC(C4C3C3C4C(OC3=O)=O)C1C(OC2=O)=O
MCULE-9425225826 0.86 C1(C)CC23CCCCCC2(C(=O)OC3=O)CC=1
MCULE-1795899971 0.86 C1CC23C(=O)OC(=O)C2(CCC3)CC=1
MCULE-2769077006 0.86 C1CC23CC(C)(C)CC2(C(=O)OC3=O)CC=1
MCULE-7609787636 0.86 O1C(=O)C2C(CC(=CC2)C)C1=O
MCULE-1413309866 0.86 CC1CC2C(OC(=O)C2CC=1C)=O
MCULE-3824820609 0.86 C1(C)CC2(C(=O)OC(=O)C2(C)CC=1)C
MCULE-1531690228 0.86 C1(COC(=O)C)C(C(=O)O)CC(C)=CC1
MolPort-000-154-940 0.86 CC1=C(C)CC2C(C1)C(=O)OC2=O
MolPort-001-018-394 0.86 CC1=CCC2C(C1)C(=O)OC2=O
MolPort-002-525-526 0.85 CC(=O)O[C@H]1CC[C@@]2(C)C(CC[C@]3(C)C2C(=O)C=C2[C@H]4C[C@](C)(CC[C@]4(C)CC[C@@]32C)C(O)=O)C1(C)C
MolPort-002-169-466 0.85 CC(=O)OC1CCC2(C)C(CCC3(C)C2C(=O)C=C2C4CC(C)(CCC4(C)CCC32C)C(O)=O)C1(C)C
MolPort-030-082-369 0.85 CC(=O)O[C@H]1CC[C@@]2(C)C(CC[C@]3(C)C2C(=O)C=C2[C@@H]4C[C@](C)(CC[C@]4(C)CC[C@@]32C)C(O)=O)C1(C)C
MolPort-002-524-866 0.85 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)[C@H]2C1
MolPort-039-338-335 0.85 C[C@@]12CC[C@H]3C(=CC[C@H]4C(C)(C)C(=O)CC[C@]34C)[C@@]1(C)CC[C@H]2[C@H]1COC(=O)C1
MolPort-028-196-343 0.85 O=C(CC1CCCC1)OCC1CCC=CC1
MolPort-001-764-881 0.85 O=C1OC(=O)C2C1C1C=CC2C2C1C(=O)OC2=O
MolPort-002-088-576 0.85 OC(=O)C1C2CC(C=C2)C1C(=O)OC1CC2CCC1C2
MolPort-004-951-336 0.85 O=C1OC(=O)C2C1C1C=CC2C2CC12
MolPort-001-766-634 0.85 CC1CCC2=C(C)C3C4C(C(=O)OC4=O)C2(C1)C1C3C(=O)OC1=O
MolPort-000-145-850 0.85 CC1=CC2(C)C3C(C1C1C2C(=O)OC1=O)C(=O)OC3=O
MCULE-2014291882 0.85 C(OCC)(C1CC=C2C1(C)CCC1C2CCC2(O)CC(O)CCC21CO)=O
MCULE-3754202975 0.85 C12C3C(C)(CCC(C)(C(O)=O)C3)CCC1(C)C1(C(C(=O)C=2)C2(C)CCC(C(C)(C)C2CC1)OC(C)=O)C
MCULE-6906348244 0.85 C(C)(=O)OC1CCC2(C)C([H])(C1)CC=C1C3CCC(C(C)C=CC(C)C(C)C)C3(C)CC(C21C)=O
MCULE-8166977907 0.85 O=C(OCC1CC=CCC1)CC1CCCC1
MCULE-2602485743 0.85 C123CC(C)CCC1=C(C(C1C(OC(=O)C21)=O)C1C(OC(=O)C31)=O)C
MCULE-5393900833 0.85 C(C)(=O)OC1CCC2(C)C3(C4C(OC(C4C4(C5CCC(C(C)C=CC(C)C(C)C)C5(C)CCC42[H])C=C3)=O)=O)C1
MCULE-3458261213 0.85 C12C3C(=O)OC(=O)C3C(C3C1C(=O)OC3=O)C=C2
MCULE-9897298185 0.85 C12C(C(=O)OC1=O)C13CCCCC1=CC2C1C(=O)OC(=O)C31
MCULE-1400366705 0.85 [C@H]12C[C@H]1[C@H]1C=C[C@@H]2[C@@H]2C(=O)OC(=O)[C@@H]21
MCULE-7155641625 0.85 C(=O)(OC1CC2CC1CC2)C1C(C(O)=O)C2CC1C=C2
MCULE-5289910824 0.85 C12CC1C1C=CC2C2C(=O)OC(=O)C21
MCULE-3232378757 0.85 C12(C)C=C(C)C(C3C(OC(=O)C13)=O)C1C(OC(=O)C21)=O
MCULE-1729468181 0.85 C1=CC2C3CC(=O)C3C1C1C(=O)OC(=O)C12
MCULE-4967241885 0.85 C1(C)C2C3C(=O)OC(=O)C3C(C2)C=1
MCULE-9416510641 0.85 C1(=O)[C@H]2[C@H]3C[C@H](C=C3)[C@H]2C(=O)O1
MCULE-7015396651 0.85 C12C(=O)OC(=O)C1C1CCCC2C=C1
MCULE-3179520262 0.85 C1(=O)[C@H]2[C@@H]3C[C@@H](C=C3)[C@H]2C(=O)O1
MCULE-9368478699 0.85 O=C1[C@]2([H])[C@]([C@@]3(C=C[C@@]2([H])C3)[H])(C)C(=O)O1
MCULE-5816353779 0.85 O1C(=O)C2C(CC(=CC2)CC/C=C(\C)/C)C1=O
MCULE-7212307650 0.85 C1CC2CC1C1=C2C2CC1C1C(=O)OC(=O)C12
MCULE-8117200139 0.85 [C@]12([H])C(=O)OC(=O)[C@@]1([H])[C@]1([H])C[C@@]2([H])C(=C1)C
MCULE-7718531263 0.85 C1(=O)C2C3CC(C=C3)C2C(=O)O1
MCULE-1210480263 0.85 C1CC(C(=O)OCC)CCC=1
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