SANC01079 Peucedanol




Analog ID Similarity score SMILES

Selection options

Mcule | MolPort | All | None
MolPort-044-562-389 1 CC(C)(O)[C@H](O)Cc1cc2ccc(=O)oc2cc1O
MCULE-6414382567 0.88 C1(C[C@@H](O)C(O)(C)C)C=C2C=CC(=O)OC2=CC=1OC
MCULE-8626686689 0.83 C1(C[C@@H](O)C(O)(C)C)C(OC)=C2C=CC(=O)OC2=CC=1OC
MCULE-2595216971 0.83 C1(=C(OC)C2C=CC(=O)OC=2C=C1OC)CC(O)C(C)(C)O
MolPort-005-981-190 0.83 COc1cc2oc(=O)ccc2c(OC)c1CC(O)C(C)(C)O
MolPort-000-882-159 0.83 COc1cc2oc(=O)ccc2c(OC)c1C[C@@H](O)C(C)(C)O
MCULE-3641883132 0.81 C(C1=C(OC)C=C2C(C=CC(=O)O2)=C1)(C(C(C)(O)C)O)O
MolPort-001-742-701 0.81 COc1cc2oc(=O)ccc2cc1C(O)C(O)C(C)(C)O
MCULE-4926964615 0.77 O1[C@H](C(C)(C)O)CC2=CC3C=CC(=O)OC=3C=C12
MCULE-3509624985 0.77 O1[C@H](C(C)(C)O)CC2=CC3C=CC(=O)OC=3C=C12
MCULE-3188434807 0.77 O1C(C(C)(C)O)CC2=CC3C=CC(=O)OC=3C=C12
MCULE-1893201582 0.77 O1[C@@H](C(C)(C)O)CC2=CC3C=CC(=O)OC=3C=C12
MCULE-9073692476 0.77 O1[C@@H](C(C)(C)O)CC2=CC3C=CC(=O)OC=3C=C12
MCULE-9592360783 0.77 C1(=O)C2C=CC=CC=2C2C(=CC(=C(CC)C=2)O)O1
MCULE-4879643725 0.77 C12C(C)=CC(=O)OC1=CC(=C(CCCCCC)C=2)O
MolPort-002-531-561 0.77 CC(C)(O)[C@H]1Cc2cc3ccc(=O)oc3cc2O1
MolPort-001-913-428 0.77 CC(C)(O)C1Cc2cc3ccc(=O)oc3cc2O1
MolPort-002-321-244 0.77 CC(C)(O)[C@@H]1Cc2cc3ccc(=O)oc3cc2O1
MolPort-000-652-314 0.77 CCc1cc2c(cc1O)oc(=O)c1ccccc21
MolPort-002-893-148 0.77 CCCCCCc1cc2c(C)cc(=O)oc2cc1O
MCULE-1990622878 0.76 O1C(C)(C)[C@@H](O)CC2C=C3C=CC(=O)OC3=CC1=2
MCULE-1817657261 0.76 C12C=C3CC(O)C(C)(C)OC3=CC=1OC(=O)C=C2
MCULE-2627246144 0.76 C12C=C3C[C@H](O)C(C)(C)OC3=CC=1OC(=O)C=C2
MCULE-9366261911 0.76 C12=CC(O)=C(C=C1C(=CC(=O)O2)C)CCC(O)=O
MolPort-003-757-486 0.76 Cc1cc(=O)oc2cc(O)c(CCC(O)=O)cc12
MolPort-003-820-436 0.76 CC1(C)Oc2cc3oc(=O)ccc3cc2CC1O
MolPort-029-945-088 0.76 CC1(C)Oc2cc3oc(=O)ccc3cc2C[C@@H]1O
MCULE-8312057527 0.75 C1(C(OC)C(O)C(O)(C)C)C=C2C=CC(=O)OC2=CC=1OC
MolPort-019-936-857 0.75 COC(C(O)C(C)(C)O)c1cc2ccc(=O)oc2cc1OC
MCULE-9374810339 0.74 C12C(=CC(=C(OC)C=1)CCC)C=CC(=O)O2
MolPort-003-811-259 0.74 CCCc1cc2ccc(=O)oc2cc1OC
MCULE-6120455835 0.73 C12C=C(O)C(CCCCCC)=CC=1C(CC(=O)O)=CC(=O)O2
MCULE-1595240372 0.73 C12=CC(O)=C(C=C1C(=CC(=O)O2)C)CCC(OC)=O
MCULE-2731589245 0.73 C1(CC(O)C(O)(C)C)C=C2C=C(C(C)(C)C=C)C(=O)OC2=CC=1OC
MCULE-8267863840 0.73 C1(C[C@H](O)C(=C)C)C(OC)=C2C=CC(=O)OC2=CC=1OC
MCULE-5986146284 0.73 C1(C[C@@H](O)C(=C)C)C(OC)=C2C=CC(=O)OC2=CC=1OC
MolPort-039-338-666 0.73 COc1cc2oc(=O)ccc2c(OC)c1C[C@H](O)C(C)=C
MolPort-002-671-364 0.73 COC(=O)CCc1cc2c(C)cc(=O)oc2cc1O
MolPort-019-937-458 0.73 COc1cc2oc(=O)c(cc2cc1CC(O)C(C)(C)O)C(C)(C)C=C
MolPort-039-338-667 0.73 COc1cc2oc(=O)ccc2c(OC)c1C[C@@H](O)C(C)=C
MCULE-8690220509 0.72 C1(=O)OC2=C(C[C@H](O)C(O)(C)C)C(OC)=CC=C2C=C1
MCULE-6954974267 0.72 C1C=C2C=CC(OC2=C(CC(O)C(O)(C)C)C=1OC)=O
MCULE-2603375415 0.72 C1C=C2C=CC(=O)OC2=C(C[C@H](O)C(O)(C)C)C=1OC
MCULE-1547002152 0.72 C12=CC=CC=C1C(O)=C(C(=O)O2)CCCC
MCULE-6301217737 0.72 C1(=O)C2C=CC=CC=2C2C(=CC(=C(CCCCCC)C=2)OCC)O1
MCULE-8374640454 0.72 C1C(=O)OC2=C(C=C(C=C2)CC)C=1O
MCULE-1891035353 0.72 C12=CC(O)=C(C=C1C(=CC(=O)O2)CCC)CCC
MolPort-001-740-397 0.72 COc1ccc2ccc(=O)oc2c1CC(O)C(C)(C)O
MolPort-002-043-481 0.72 CCCCc1c(O)c2ccccc2oc1=O
MolPort-004-832-774 0.72 CCCCCCc1cc2c(cc1OCC)oc(=O)c1ccccc21
MolPort-000-155-260 0.72 CCc1ccc2oc(=O)cc(O)c2c1
MolPort-005-919-320 0.72 CCCc1cc2c(CCC)cc(=O)oc2cc1O
MolPort-035-705-774 0.72 COc1ccc2ccc(=O)oc2c1C[C@H](O)C(C)(C)O
MCULE-1298371552 0.71 C1(C#N)=CC2=CC(CCCCCC)=C(C=C2OC1=O)O
MCULE-1618611330 0.71 C1C=C2C=CC(OC2=C(CC(O)C(OC)(C)C)C=1OC)=O
MCULE-1201554170 0.71 C12=CC(O)=C(C=C1C(=CC(=O)O2)C)CCC(OC(C)C)=O
MCULE-7508391798 0.71 C12=CC(O)=C(C=C1C(=CC(=O)O2)C)CCC(OCC)=O
MCULE-8385066900 0.71 C1(=O)C2C=CC=CC=2C2C(=CC(=C(C(C)=O)C=2)O)O1
MCULE-7156413895 0.71 C12=C(C)C3OC(C)(C)CCC=3C=C1C1=C(C=CC=C1)C(=O)O2
MolPort-005-944-677 0.71 COc1ccc2ccc(=O)oc2c1CC(O)C(C)(C)OC
MolPort-046-163-463 0.71 CC(=O)c1cc2c(cc1O)oc(=O)c1ccccc21
MolPort-002-133-781 0.71 CCCCCCc1cc2cc(C#N)c(=O)oc2cc1O
MolPort-002-520-401 0.71 Cc1c2OC(C)(C)CCc2cc2c1oc(=O)c1ccccc21
MolPort-003-757-484 0.71 CCOC(=O)CCc1cc2c(C)cc(=O)oc2cc1O
MolPort-003-757-485 0.71 CC(C)OC(=O)CCc1cc2c(C)cc(=O)oc2cc1O
MCULE-2811227356 0.70 C12C=C(CCCCCC)C(O)=CC=1OC(=O)C=C2CC(=O)OC
MCULE-4525452317 0.70 C12C=C(O)C(=CC=1C(=CC(=O)O2)C)CC
MCULE-7035360077 0.70 C12=CC(O)=CC=C1C(CCCC)=CC(=O)O2
MCULE-2647692268 0.70 O1C(CC2=CC3C=CC(=O)OC=3C=C12)C(C)(C)OC(C)=O
MCULE-8125910719 0.70 O1[C@@H](CC2=CC3C=CC(=O)OC=3C=C12)C(C)(C)OC(C)=O
MCULE-9024903790 0.70 C1C=C2C=CC(=O)OC2=C(CCC(O)(C)C)C=1OC
MCULE-9105239910 0.70 C12=CC3=C(C=C1C(=CC(=O)O2)C)CCC(C)(C)O3
MolPort-000-846-372 0.70 CCCCc1cc(=O)oc2cc(O)ccc12
MolPort-000-872-388 0.70 CCc1cc2c(C)cc(=O)oc2cc1O
MolPort-007-571-742 0.70 CC(=O)OC(C)(C)C1Cc2cc3ccc(=O)oc3cc2O1
MolPort-044-754-062 0.70 COc1ccc2ccc(=O)oc2c1CCC(C)(C)O
MolPort-002-321-253 0.70 CC(=O)OC(C)(C)[C@@H]1Cc2cc3ccc(=O)oc3cc2O1
MolPort-002-527-808 0.70 Cc1cc(=O)oc2cc3OC(C)(C)CCc3cc12
MCULE-1399939483 0.69 C12C(=CC3CCOC=3C=1)C=CC(=O)O2
MCULE-8664158585 0.69 C1(C(O)C(OC(=O)CC(C)C)C(O)(C)C)C=C2C=CC(=O)OC2=CC=1OC
MolPort-019-937-377 0.69 COc1cc2oc(=O)ccc2cc1C(O)C(OC(=O)CC(C)C)C(C)(C)O
MCULE-9486477421 0.68 C1C=C2C=CC(=O)OC2=C(C[C@H](O)C(C)(C)OCC)C=1OC
MCULE-7383180734 0.68 C1C=C2C=CC(=O)OC2=C(CC(C(OCC)(C)C)O)C=1OC
MCULE-4538111291 0.68 C1(CC(O)=O)=CC(=O)OC2=CC(O)=C(CC)C=C21
MCULE-7458020390 0.68 C1(C(C)=O)=CC2C=C(CCCCCC)C(=CC=2OC1=O)O
MCULE-5939466226 0.68 C12=CC(OC)=C(C=C1C(=CC(=O)O2)C)CCC(O)=O
MCULE-9814687802 0.68 C12=C(C)C3OC(C)(C)CCC=3C=C1C1=C(C=C(C=C1)OC)C(=O)O2
MCULE-6714659257 0.68 C1(C(C2C=CC=CC=2)CC(CC)O)C(=O)OC2C(=CC=CC=2)C=1O
MCULE-8340673942 0.68 C12OC(=O)C=CC=1C(OC)=CC(OC)=C2CC(O)C(C)(C)O
MCULE-9038910597 0.68 C1C(OC)=C2C=CC(=O)OC2=C(C[C@H](O)C(O)(C)C)C=1OC
MCULE-4564512392 0.68 C12=CC(O)=CC=C1C(CCC)=CC(=O)O2
MCULE-3700572588 0.68 C1(=O)C2C=CC=CC=2C2C(=CC(=CC=2)OCCC2C=CC=CC=2)O1
MCULE-2258796365 0.68 C1(C2=CC=CC=C2)=CC(=O)OC2=CC(O)=C(CCCCCC)C=C12
MCULE-7647876645 0.68 C1(CC(C)(C)CCC=1C)CC1=CC2C=CC(OC=2C=C1O)=O
MCULE-2706122818 0.68 C12=CC3=C(C=C1C(=CC(=O)O2)CC)CCC(C)(C)O3
MCULE-5244353828 0.68 C1(C(OC)C(O)C(=C)C)C=C2C=CC(=O)OC2=CC=1OC
MolPort-003-757-489 0.68 COc1cc2oc(=O)cc(C)c2cc1CCC(O)=O
MolPort-003-179-146 0.68 CCC(O)CC(c1ccccc1)c1c(O)c2ccccc2oc1=O
MolPort-002-536-611 0.68 COc1ccc2c3cc4CCC(C)(C)Oc4c(C)c3oc(=O)c2c1
MolPort-002-526-072 0.68 CC(=C)[C@H]1Cc2cc3ccc(=O)oc3cc2O1
MolPort-000-702-406 0.68 CCCCCCc1cc2cc(C(C)=O)c(=O)oc2cc1O
MolPort-000-655-344 0.68 CCCc1cc(=O)oc2cc(O)ccc12
MolPort-000-666-860 0.68 O=c1oc2cc(OCCc3ccccc3)ccc2c2ccccc12
MolPort-002-367-258 0.68 CCCCCCc1cc2c(cc(=O)oc2cc1O)-c1ccccc1
MolPort-002-217-240 0.68 CC1=C(Cc2cc3ccc(=O)oc3cc2O)CC(C)(C)CC1
MolPort-002-529-815 0.68 CCc1cc(=O)oc2cc3OC(C)(C)CCc3cc12
MolPort-002-330-416 0.68 CC(=C)[C@@H]1Cc2cc3ccc(=O)oc3cc2O1
MolPort-001-913-431 0.68 CC(=C)C1Cc2cc3ccc(=O)oc3cc2O1
MolPort-019-937-456 0.68 COC(C(O)C(C)=C)c1cc2ccc(=O)oc2cc1OC
MolPort-039-052-483 0.68 CCOC(C)(C)[C@@H](O)Cc1c(OC)ccc2ccc(=O)oc12
MolPort-023-298-874 0.68 CCOC(C)(C)C(O)Cc1c(OC)ccc2ccc(=O)oc12
MolPort-044-723-214 0.68 COc1cc(OC)c2ccc(=O)oc2c1C[C@H](O)C(C)(C)O
MCULE-2862493952 0.67 C12C=CC=CC=1C(O)=C(C(=O)O2)CC
MCULE-2158827311 0.67 C12C(C)=C(O)C(=CC=1C1=C(C=CC=C1)C(=O)O2)CC=C
MCULE-7468637893 0.67 C12=C(C)C(O)=C(C=C1C1C(=CC=CC=1)C(=O)O2)C(C)=O
MCULE-8400166872 0.67 OC(CCC1C(=O)OC2=C(C=CC(=C2)O)C=1)=O
MCULE-1097219345 0.67 O1C(C(C)(C)Cl)CC2=CC3C=CC(=O)OC=3C=C12
MCULE-4653744945 0.67 C12=CC(O)=C(C=C1C(=CC(=O)O2)C)CCC(OCCOC)=O
MCULE-4212057680 0.67 O1[C@@H](C(C)(C)Cl)CC2=CC3C=CC(=O)OC=3C=C12
MCULE-8386777819 0.67 C12C[C@H](C(O)(C)C)OC=1C(O)=C1OC(=O)C=CC1=C2
MCULE-9022340447 0.67 C12C[C@@H](C(O)(C)C)OC=1C(O)=C1OC(=O)C=CC1=C2
MCULE-4721059845 0.67 C1=C2OC(=O)C=CC2=CC(C/C=C(\C)/C)=C1O
MCULE-2275782008 0.67 C12=CC(O)=C(C=C1C(=CC(=O)O2)CCCC)O
MCULE-1072130884 0.67 C12OC(=O)C=C(C)C1=CC(CC(CBr)Br)=C(O)C=2C
MCULE-1464339007 0.67 C1(C2=CC=CC=C2)=CC(=O)OC2=CC(O)=C(CCC(O)=O)C=C12
MCULE-5809628566 0.67 C12=CC(OC)=C(C=C1C(=CC(=O)O2)C)CCC(OC)=O
MCULE-3070662314 0.67 C12C3=CC=C(O)C=C3OC=1C1=C(C=C3C(CCC(C)(C)O3)=C1)OC2=O
MCULE-3815309367 0.67 C12OC(=O)C=C(C)C1=CC(C(CC)=O)=C(O)C=2C
MCULE-8803014525 0.67 C1(C2=CC=CC=C2)=CC(=O)OC2=CC(O)=C(CCC)C=C12
MCULE-7375540010 0.67 C1(C(C)(C)CC(C)=O)C(=O)OC2=C(C=CC=C2)C=1O
MolPort-039-338-286 0.67 CC(C)(O)[C@@H]1Cc2cc3ccc(=O)oc3c(O)c2O1
MolPort-039-338-538 0.67 CC(C)(O)[C@H]1Cc2cc3ccc(=O)oc3c(O)c2O1
MolPort-046-510-396 0.67 OC(=O)CCc1cc2ccc(O)cc2oc1=O
MolPort-002-043-389 0.67 CCc1c(O)c2ccccc2oc1=O
MolPort-002-228-536 0.67 Cc1c(O)c(CC=C)cc2c1oc(=O)c1ccccc21
MolPort-002-714-535 0.67 CCC(=O)c1cc2c(C)cc(=O)oc2c(C)c1O
MolPort-001-913-432 0.67 CC(C)(Cl)C1Cc2cc3ccc(=O)oc3cc2O1
MolPort-002-526-022 0.67 CC(C)(Cl)[C@H]1Cc2cc3ccc(=O)oc3cc2O1
MolPort-001-742-280 0.67 CC(C)=CCc1cc2ccc(=O)oc2cc1O
MolPort-002-507-631 0.67 CCCCc1cc(=O)oc2cc(O)c(O)cc12
MolPort-006-318-852 0.67 Cc1cc(=O)oc2c(C)c(O)c(CC(Br)CBr)cc12
MolPort-008-010-254 0.67 OC(=O)CCc1cc2c(cc(=O)oc2cc1O)-c1ccccc1
MolPort-000-688-646 0.67 CCCc1cc2c(cc(=O)oc2cc1O)-c1ccccc1
MolPort-002-536-108 0.67 CC(=O)c1cc2c3ccccc3c(=O)oc2c(C)c1O
MolPort-000-842-544 0.67 COC(=O)CCc1cc2c(C)cc(=O)oc2cc1OC
MolPort-002-799-316 0.67 CC(=O)CC(C)(C)c1c(O)c2ccccc2oc1=O
MCULE-1287628774 0.66 C1(C)=C(C)C(=O)OC2=CC3OC(C)(C)CCC=3C=C12
MCULE-7626542047 0.66 C12=CC3=C(C=C1C(=CC(=O)O2)CCC)CCC(C)(C)O3
MCULE-7306447252 0.66 C1C=C2C=CC(=O)OC2=C(C[C@@H]2OC2(C)C)C=1OC
MCULE-6120837821 0.66 O1C(C1CC1=C(OC)C=CC2=C1OC(C=C2)=O)(C)C
MCULE-3342615934 0.66 C12=CC3=C(C=C1C(=CC(=O)O2)CCCC)CCC(C)(C)O3
MCULE-4862423497 0.66 C1(=O)OC2=C(C=CC(O)=C2)C(C)=C1CCO
MCULE-7175369882 0.66 C12C(O)=C(C)C=CC=1OC(C=C2O)=O
MCULE-7971404433 0.66 C1=C2OC(C(C(C)(C)C=C)=CC2=CC2C[C@H](OC=21)C(C)(C)O)=O
MCULE-9477064770 0.66 C12=CC3C=CC(OC=3C=C1OC(C(C)C)C2=O)=O
MCULE-7867105502 0.66 C1(C(O)=O)=CC2C=C(CCCCCC)C(=CC=2OC1=O)O
MCULE-7328443090 0.66 C12OC(=O)C=C(C)C1=CC(=C(O)C=2CO)CCC
MCULE-6900646514 0.66 C12=C(C)C(O)=CC=C1C(=CC(=O)O2)CCCC
MCULE-9923066694 0.66 C12OC(=O)C=C(C)C1=CC1CCC(C)(C)OC=1C=2C
MCULE-2456772341 0.66 C1(C2=CC=CC=C2)=CC(=O)OC2=CC(O)=C(CCC(OC)=O)C=C12
MCULE-2184763163 0.66 C1(CC(OC)=O)=CC(=O)OC2=CC(O)=C(CC)C=C21
MCULE-7378628596 0.66 C1(CCCC)=CC(=O)OC2=CC(C)=CC(O)=C12
MCULE-4748753724 0.66 C12OC(=O)C=C(CCCC)C1=CC=C(O)C=2O
MCULE-6299044943 0.66 C1(CC(O)=O)=CC(=O)OC2C=C(O)C=CC=21
MCULE-4484700268 0.66 C1(C)=CC(=O)OC2C=C(CCCCC)C=C(O)C1=2
MCULE-9977090772 0.66 C1(CCCC)=CC(=O)OC2=CC(O)=CC(O)=C12
MolPort-002-509-445 0.66 COc1ccc2ccc(=O)oc2c1CC1OC1(C)C
MolPort-001-683-818 0.66 Cc1c(C)c(=O)oc2cc3OC(C)(C)CCc3cc12
MolPort-002-528-858 0.66 CCCc1cc(=O)oc2cc3OC(C)(C)CCc3cc12
MolPort-002-528-414 0.66 CCCCc1cc(=O)oc2cc3OC(C)(C)CCc3cc12
MolPort-003-801-271 0.66 Cc1c(CCO)c(=O)oc2cc(O)ccc12
MolPort-002-018-540 0.66 Cc1ccc2oc(=O)cc(O)c2c1O
MolPort-001-913-433 0.66 CC(C)C1Oc2cc3oc(=O)ccc3cc2C1=O
MolPort-002-137-211 0.66 CCCCCCc1cc2cc(C(O)=O)c(=O)oc2cc1O
MolPort-000-690-972 0.66 CCCCc1cc(=O)oc2c(C)c(O)ccc12
MolPort-002-521-555 0.66 Cc1cc(=O)oc2c(C)c3OC(C)(C)CCc3cc12
MolPort-001-662-727 0.66 CCCCCc1cc(O)c2c(C)cc(=O)oc2c1
MolPort-002-237-172 0.66 CCCCc1cc(=O)oc2cc(C)cc(O)c12
MolPort-000-693-528 0.66 CCCCc1cc(=O)oc2cc(O)cc(O)c12
MolPort-000-159-435 0.66 OC(=O)Cc1cc(=O)oc2cc(O)ccc12
MolPort-000-693-514 0.66 CCCCc1cc(=O)oc2c(O)c(O)ccc12
MolPort-001-741-243 0.66 CC(C)(O)[C@@H]1Cc2cc3cc(c(=O)oc3cc2O1)C(C)(C)C=C
MolPort-029-887-058 0.66 COc1ccc2ccc(=O)oc2c1C[C@@H]1OC1(C)C
MolPort-044-831-658 0.66 CCCc1cc2c(C)cc(=O)oc2c(CO)c1O
MolPort-002-207-203 0.65 CCCCc1cc(=O)oc2cc(OC)ccc12
MolPort-001-662-743 0.65 CCCCCCCc1cc(O)c2c(C)cc(=O)oc2c1
MolPort-001-662-728 0.65 CCCc1cc(O)c2c(C)cc(=O)oc2c1
MolPort-002-507-630 0.65 CCCc1cc(=O)oc2cc(O)c(O)cc12
MolPort-002-367-176 0.65 CCc1cc(=O)oc2cc(O)ccc12
MolPort-002-465-094 0.65 CC(C)c1cc(=O)oc2cc(O)ccc12
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MolPort-000-735-689 0.61 [Na+].CCO.CCC(=O)CC(c1ccccc1)c1c([O-])c2ccccc2oc1=O
MolPort-002-846-520 0.61 COc1cc2oc3cc4OC(C)(C)CCc4cc3c(=O)c2cc1OC
MolPort-002-838-283 0.61 CCCCCCOc1cc2oc(=O)cc(C)c2cc1CC
MolPort-000-710-597 0.61 CCCCc1c(C)c2ccc(OC)cc2oc1=O
MolPort-002-126-192 0.61 Cc1cc(=O)oc2cc(OC(=O)CCc3ccccc3)ccc12
MolPort-002-200-454 0.61 CCCCc1cc(=O)oc2cc(OCC(=O)c3ccc4ccccc4c3)ccc12
MolPort-000-688-971 0.61 CCCCCCc1cc2c3CCCCc3c(=O)oc2cc1O
MolPort-000-691-011 0.61 Cc1c(CCC(O)=O)c(=O)oc2cc(O)ccc12
MolPort-000-690-956 0.61 CCCCc1cc(=O)oc2cc(OCC(=O)c3ccccc3)ccc12
MolPort-002-521-930 0.61 CCc1cc(=O)oc2cc(C)c3CCC(C)(C)Oc3c12
MolPort-005-910-279 0.61 COC(=O)C(Cc1ccccc1)c1cc(=O)oc2cc(OC)ccc12
MolPort-019-937-376 0.61 COc1cc2oc(=O)ccc2cc1C(OC(=O)C=C(C)C)C(O)C(C)(C)O
MolPort-044-431-052 0.61 Cc1cc2oc(=O)c(C)c(C)c2c2OC(C)(C)CCc12
MolPort-044-431-053 0.61 Cc1cc(=O)oc2cc3OC(C)(C)CC(=O)c3cc12
MolPort-027-564-894 0.61 [2H]c1c([2H])c([2H])c([C@@H](CC(C)=O)c2c(O)c3ccccc3oc2=O)c([2H])c1[2H]
MolPort-019-999-082 0.61 CC(C)=CC(=O)OC1Cc2cc3ccc(=O)oc3cc2OC1(C)C
MolPort-002-299-512 0.61 CCCCc1cc(=O)oc2cc(OCC(=O)C(C)(C)C)ccc12
MolPort-000-688-507 0.61 CC(Oc1ccc2c(C)cc(=O)oc2c1)C(=O)c1ccccc1
MolPort-006-069-438 0.61 CC(C)=CC(=O)O[C@H]1Cc2cc3ccc(=O)oc3cc2OC1(C)C
MolPort-002-324-901 0.61 CC(=O)c1cc2c(C)cc(=O)oc2c(C)c1O
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MolPort-002-133-458 0.61 OC(CC(c1ccccc1)c1c(O)c2ccccc2oc1=O)c1ccc(cc1)-c1ccccc1
MolPort-019-940-206 0.61 CC(=O)CC(c1ccccc1)c1c([O-])c2ccccc2oc1=O
MolPort-002-085-915 0.61 CCc1cc(=O)oc2cc(C)cc(O)c12
MolPort-008-003-269 0.61 COc1cc2oc(=O)cc(-c3ccccc3)c2cc1CCC(O)=O
MolPort-002-507-634 0.61 CCCCCCc1c(C)c2cc(O)c(O)cc2oc1=O
MolPort-000-693-525 0.61 CCc1cc(=O)oc2cc(O)cc(O)c12
MolPort-000-846-901 0.61 CCCCC(=O)c1cc2ccc(O)cc2oc1=O
MolPort-002-954-975 0.61 CCOC(=O)Cc1cc(=O)oc2cc(O)ccc12
MolPort-000-467-367 0.61 Cc1cc(=O)oc2cc(O)ccc12
MolPort-004-832-764 0.61 OC(=O)Cc1cc(=O)oc2cc(O)cc(O)c12
MolPort-000-820-976 0.61 CC(=O)c1cc2ccc(O)cc2oc1=O
MolPort-002-506-966 0.61 CC(=O)C[C@@H](c1ccccc1)c1c(O)c2ccccc2oc1=O
MolPort-001-787-822 0.61 CC(=O)CC(c1ccccc1)c1c(O)c2ccccc2oc1=O
MolPort-003-959-875 0.61 CC(=O)C[C@H](c1ccccc1)c1c(O)c2ccccc2oc1=O
MolPort-003-850-868 0.61 [2H]c1c([2H])c([2H])c(C(CC(C)=O)c2c(O)c3ccccc3oc2=O)c([2H])c1[2H]
MCULE-3792002428 0.60 [Na+].C12=CC(=CC=C1C(=CC(=O)O2)C)[O-]
MCULE-8402247669 0.60 O1C2C(C=C(C(C)(C)C=C)C1=O)=CC1C[C@@H](C(OC(C)=O)(C)C)OC=1C=2
MCULE-5129794362 0.60 O1C(C)(C)C(CC2=CC3C=CC(=O)OC=3C=C12)OC(=O)C(C)=CC
MCULE-6769322828 0.60 O=C1C=CC2=CC3=C(C(=C2O1)C/C=C(\C)/C)OC(C(O)(C)C)C3
MCULE-5204273827 0.60 C12=CC(=CC=C1C(CCC)=CC(=O)O2)OCC(C)=O
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MCULE-9911582665 0.60 C1(=O)OC2=CC(OC)=CC=C2C(C)=C1CCC
MCULE-9562140872 0.60 O=C1OC2=CC(=C(C/C=C(\C)/C)C=C2C=C1)OC
MCULE-7630751047 0.60 C12C(=CC(=C(C(C)=O)C=1O)C)OC(C=C2C)=O
MCULE-7114900735 0.60 C12=C(C)C(O)=CC=C1C1CCCC=1C(=O)O2
MCULE-3319395490 0.60 C1(=O)C2C=CC=CC=2C2C(=CC(=C(CCCCCC)C=2)OCC2=CC=C(C=C2)C(OC)=O)O1
MCULE-5888231758 0.60 C1(=O)C2C=CC=CC=2C2C(=CC3=C(C(=O)CC4(CCCCC4)O3)C=2)O1
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MCULE-8397433624 0.60 C12C(=CC(=C(C(C)=O)C=1O)C)OC(C=C2CCC)=O
MCULE-8324098660 0.60 C1(CC(O)=O)=C(C)C2=CC=C(C=C2OC1=O)O
MCULE-3313365189 0.60 C12=C(C)C(O)=C(C=C1C(=C(C)C(=O)O2)C)C(C)=O
MCULE-1453060400 0.60 C1(C(C2CCCCC2)=O)C(=O)OC2C(=CC=CC=2)C=1O
MCULE-6603387433 0.60 C12OC(=O)C=C(CCC)C1=CC(=C(O)C=2C(C)=O)CCC
MCULE-8300676970 0.60 C12=CC(OCC(C)=C)=C(C=C1C(=CC(=O)O2)C)CCC(O)=O
MCULE-1773092339 0.60 C1(C(=O)OC2C=CC=CC=2C=1O)C(CC(=O)C)C1=CC=C(O)C=C1
MCULE-6349764105 0.60 C12OC(=O)C=C(C)C1=CC(C(CC)=O)=C(OC)C=2C
MCULE-6661037508 0.60 C1(=O)C(CCC(OCC)=O)=CC2C(=CC(=CC=2)OC)O1
MCULE-3028381227 0.60 C1(C(C2C=CC=CC=2)CC(CC)=O)C(=O)OC2=C(C=CC=C2)C=1[O-]
MCULE-8718146678 0.60 C1(C(=O)CC2CCCCC2)C(=O)OC2C(=CC=CC=2)C=1O
MCULE-4770488807 0.60 C1(=O)OC2=CC(=CC=C2C(C)=C1C)OCC(=O)C1=CC=C(C=C1)CCCCC
MCULE-3637636424 0.60 C1(CC(OCC)=O)C(=O)OC2=C(C=C(C(O)=C2)CCCCCC)C=1C
MCULE-8990388805 0.60 C12=C(C=C(C3CC(C)OC1=3)C)OC(C(C)=C2C)=O
MCULE-2764548629 0.60 C12=CC(OC)=CC=C1C(CC)=CC(=O)O2
MCULE-4218197465 0.60 O1C(=O)C=CC2C=CC(OCC(=O)C3=CC=C(C=C3)C)=CC1=2
MCULE-8909446076 0.60 C1(=O)C2C=CC=CC=2C2C(=CC(=CC=2)OCC(=O)C2=CC=C(C=C2)C)O1
MCULE-4966406889 0.60 C1(=O)OC2C=C(O)C=CC=2C2CCCCC=21
MCULE-6838444699 0.60 C1(C)=C(CCCCCC)C(=O)OC2=CC(C)=CC(O)=C12
MCULE-3084614865 0.60 C1(C(C)=O)C(=O)OC2=C(C=CC=C2)C=1O
MCULE-5734595030 0.60 C12=CC(=CC=C1C(CCCC)=CC(=O)O2)OC(C)C(O)=O
MCULE-5149927058 0.60 C1(C)=C(CC)C(=O)OC2=CC(C)=CC(O)=C12
MCULE-2974019370 0.60 C1(=O)C2C=CC=CC=2C2C(=CC(=CC=2)OC(=O)C(C2=CC=CC=C2)C(C2=CC=CC=C2)C2=CC=CC=C2)O1
MCULE-6073558480 0.60 C1(CC(OC)=O)=CC(=O)OC2=CC(OC)=CC=C21
MCULE-5111071262 0.60 C1C(C)=C2C(=CC=1O)C(=O)OC(CC(O)C)=C2
MCULE-1196764977 0.60 C1(=O)OC2C=C(O)C=CC=2C(C)=C1C
MCULE-1160147804 0.60 C1(C(C2C=CC(=CC=2)O)C2C=C(C(C)(C)C)C(=C(C(C)(C)C)C=2)O)C(=O)OC2=C(C=CC=C2)C=1O
MCULE-8184253495 0.60 C12=CC(=CC=C1C(CC)=CC(=O)O2)OC(C)C(C1=CC=CC=C1)=O
MCULE-4532011204 0.60 C1(C(C)Cl)=CC(=O)OC2C=C(O)C=CC=21
MCULE-3500578178 0.60 C12=CC(O)=C(C=C1C(=CC(=O)O2)CCC)Cl
MCULE-2303749840 0.60 C12=C(C=CC(O)=C1CC=C)C=CC(=O)O2
MCULE-4046758599 0.60 C1(=O)C2C=CC=CC=2C2C(=CC(=CC=2C)OC(C)C(C2=CC=CC=C2)=O)O1
MCULE-9844268248 0.60 C12=CC(=CC=C1C(CCC)=CC(=O)O2)OC(C)C(C)=O
MCULE-9694077330 0.60 C12=CC(=CC=C1C(CCCC)=CC(=O)O2)OC(C)=O
MCULE-5063193935 0.60 C1(C(C2C=CC(=CC=2)O)CC(OC)=O)C(=O)OC2C(=CC=CC=2)C=1O
MCULE-1870737015 0.60 C1(CCC(C)C)=C(C)C2=CC=C(C=C2OC1=O)OCCCCC
MCULE-4986304152 0.60 C12CCCCC=1C(=O)OC1=CC(O)=C(CC)C=C21
MCULE-4276777960 0.60 C12C(O)=CC=CC=1C(=O)C1C(O)=CC(O)=C(CCC(O)(C)C)C=1O2
MCULE-9601855030 0.60 C12=C(C=CC(O)=C1C(C)=O)C=CC(=O)O2
MCULE-9344015769 0.60 C1(=O)OC2C=C(OCC)C=CC=2C(C)=C1CCCC
MCULE-3112741509 0.60 C12OC(=O)C=CC1=CC(C)=C(OCC(C(C)(C)O)([H])O)C=2
MCULE-5858527351 0.60 C1(C2=CC=CC=C2)=CC(=O)OC2=CC(OCC)=C(CCCCCC)C=C12
MCULE-3544122062 0.60 C1(=O)OC2=CC(OCCCC)=CC=C2C(C)=C1CCCCC
MCULE-4616748332 0.60 C12=C(C)C(O)=CC=C1C(=CC(=O)O2)CC(OC)=O
MCULE-1464170829 0.60 C12=C(C)C(=CC=C1C1C=CC=CC=1C(=O)O2)OC(C)C(C1=CC=CC=C1)=O
MCULE-7644344124 0.60 C1(=O)C2C=CC=CC=2C2C(=CC(=CC=2C)O)O1
MCULE-9851797227 0.60 C1C=C2C=CC(OC2=C(C(C(O)C(=C)C)O)C=1OC)=O
MCULE-8371389991 0.60 C1(=O)OC2=C(C=CC=C2)C(O)=C1C1C2=C(C=CC=C2)CCC1
MCULE-2359418398 0.60 C1C=C2C=CC(=O)OC2=C([C@@H](O)[C@@H](O)C(C)=C)C=1OC
MCULE-6609756461 0.60 C1(C(CC(C)=O)C2C=CC(=CC=2)O)C(=O)OC2=C(C=CC=C2)C=1[O-].[Na+]
MCULE-5294408572 0.60 [Na+].C1(C(C2C=CC=CC=2)CC(CC)=O)C(=O)OC2=C(C=CC=C2)C=1[O-]
MCULE-1017177266 0.60 C1C=C2C=CC(=O)OC2=C([C@@H](O)[C@H](O)C(C)=C)C=1OC
MCULE-7906590754 0.60 C12=CC(=CC=C1C(CCCC)=CC(=O)O2)OCC(O)=O
MCULE-8954486897 0.60 C12C=CC(=CC=1OC=C(CCCCC)C2=O)O
MolPort-005-922-937 0.60 CCCc1cc2c(CCC)cc(=O)oc2c(C(C)=O)c1O
MCULE-1280833674 0.60 C12OC(=O)C=C(CCCC)C1=CC=C(OC(C)C)C=2C
MolPort-001-825-188 0.60 Cc1ccc(cc1)C(=O)COc1ccc2c(c1)oc(=O)c1ccccc21
MCULE-3885854365 0.60 C12=C(C)C(OCC)=CC=C1C(=CC(=O)O2)CCCC
MolPort-002-126-445 0.60 CC1CCC(CC1)C(=O)c1c(O)c2ccccc2oc1=O
MCULE-8210794769 0.60 C1(=O)OC2=CC(OCC)=CC=C2C(C)=C1CCC
MolPort-002-126-303 0.60 Oc1c(C(=O)CC2CCCCC2)c(=O)oc2ccccc12
MCULE-9168934944 0.60 C1(C2CCCC2)=COC2C(=CC=C(O)C=2)C1=O
MolPort-003-848-115 0.60 CC(=O)CC(c1ccc(O)cc1)c1c(O)c2ccccc2oc1=O
MCULE-9987944581 0.60 C12=CC(=CC=C1C(CCC)=CC(=O)O2)OCC(=O)C(C)(C)C
MolPort-002-846-522 0.60 CC1Cc2c(O1)c1c(C)c(C)c(=O)oc1cc2C
MCULE-6440520474 0.60 C12OC(=O)C=C(CC)C1=CC(C(C)=O)=C(O)C=2C
MolPort-001-804-768 0.60 CCCCCc1ccc(cc1)C(=O)COc1ccc2c(C)c(C)c(=O)oc2c1
MCULE-8799134570 0.60 C1(CO)C=C2C=CC(=O)OC2=CC=1OC
MolPort-007-981-703 0.60 CC(=C)COc1cc2oc(=O)cc(C)c2cc1CCC(O)=O
MCULE-3809960793 0.60 C1(=O)OC2C=C(OCCC3C=CC=CC=3)C=CC=2C2CCCC=21
MolPort-002-508-510 0.60 CCCCCCc1cc2c(C)c(CC(=O)OCC)c(=O)oc2cc1O
MolPort-002-367-171 0.60 Cc1c(C)c(=O)oc2cc(O)ccc12
MolPort-000-248-604 0.60 Oc1ccc2c3CCCCc3c(=O)oc2c1
MolPort-002-290-582 0.60 Cc1ccc(cc1)C(=O)COc1ccc2ccc(=O)oc2c1
MolPort-006-318-854 0.60 CCCCCCc1c(C)c2c(O)cc(C)cc2oc1=O
MolPort-001-826-322 0.60 CCc1cc(=O)oc2cc(OC)ccc12
MolPort-002-205-050 0.60 CCCCc1cc(=O)oc2cc(OC(C)C(O)=O)ccc12
MolPort-002-043-396 0.60 CC(=O)c1c(O)c2ccccc2oc1=O
MolPort-002-046-514 0.60 O=C(Oc1ccc2c(c1)oc(=O)c1ccccc21)C(C(c1ccccc1)c1ccccc1)c1ccccc1
MolPort-002-096-076 0.60 COC(=O)Cc1cc(=O)oc2cc(OC)ccc12
MolPort-002-838-305 0.60 CCC(=O)c1cc2c(C)cc(=O)oc2c(C)c1OC
MolPort-003-720-926 0.60 CC(=O)CC(c1ccc(O)cc1)c1c([O-])c2ccccc2oc1=O
MolPort-005-910-749 0.60 CC(=O)c1c(C)cc2oc(=O)cc(C)c2c1O
MolPort-006-305-536 0.60 CCC(=O)CC(c1ccccc1)c1c([O-])c2ccccc2oc1=O
MolPort-000-688-803 0.60 CCCc1c(C)c2ccc(OC)cc2oc1=O
MolPort-046-423-238 0.60 C\C=C(\C)C(=O)O[C@H]1Cc2cc3ccc(=O)oc3cc2OC1(C)C
MolPort-046-793-098 0.60 CC(=O)C[C@@H](c1ccc(O)cc1)c1c(O)c2ccccc2oc1=O
MolPort-029-887-086 0.60 COc1ccc2ccc(=O)oc2c1CC(=O)C(C)C
MolPort-005-945-890 0.60 CC(C)=CCc1c2OC(Cc2cc2ccc(=O)oc12)C(C)(C)O
MolPort-005-945-346 0.60 CC(=O)OC(C)(C)[C@@H]1Cc2cc3cc(c(=O)oc3cc2O1)C(C)(C)C=C
MolPort-001-918-388 0.60 C\C=C(\C)C(=O)OC1Cc2cc3ccc(=O)oc3cc2OC1(C)C
MolPort-002-321-255 0.60 C\C=C(/C)C(=O)OC1Cc2cc3ccc(=O)oc3cc2OC1(C)C
MolPort-005-944-812 0.60 COc1cc2oc(=O)ccc2cc1CC=C(C)C
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MolPort-000-688-724 0.60 Cc1c(O)ccc2c3CCCc3c(=O)oc12
MolPort-000-690-933 0.60 CCCCCCc1cc2c(cc1OCc1ccc(cc1)C(=O)OC)oc(=O)c1ccccc21
MolPort-002-531-210 0.60 O=C1CC2(CCCCC2)Oc2cc3oc(=O)c4ccccc4c3cc12
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MolPort-001-683-774 0.60 CCCCOc1ccc2c(C)c(CC)c(=O)oc2c1
MolPort-000-851-153 0.60 CCCc1cc(=O)oc2cc(C)c(C(C)=O)c(O)c12
MolPort-002-507-272 0.60 Cc1c(CC(O)=O)c(=O)oc2cc(O)ccc12
MolPort-001-739-448 0.60 CC(O)Cc1cc2c(C)cc(O)cc2c(=O)o1