SANC00953 Ferulic acid




Analog ID Similarity score SMILES

Selection options

Mcule | MolPort | All | None
MolPort-001-740-991 1 OCC1OC(C(O)C(O)C1O)c1c(O)cc(O)c2c1occ(-c1ccc(O)cc1)c2=O
MCULE-6127598109 1 C(O)(=O)C=CC1=CC=C(C(OC)=C1)O
MCULE-8442047802 1 C(O)(=O)/C=C/C1=CC=C(C(OC)=C1)O
MCULE-9094428143 0.98 [Na+].C([O-])(=O)C=CC1=CC=C(O)C(OC)=C1
MCULE-5476569550 0.98 [Na+].COC1C=C(/C=C/C(=O)[O-])C=CC=1O
MolPort-003-939-176 0.97 OC[C@H]1O[C@H]([C@H](O)[C@@H](O)[C@@H]1O)c1c(O)ccc2c1occ(-c1ccc(O)cc1)c2=O
MolPort-002-519-422 0.97 OC[C@H]1OC([C@H](O)[C@@H](O)[C@@H]1O)c1c(O)ccc2c1occ(-c1ccc(O)cc1)c2=O
MolPort-005-943-411 0.97 OCC1OC(C(O)C(O)C1O)c1c(O)ccc2c1occ(-c1ccc(O)cc1)c2=O
MolPort-005-945-040 0.96 OCC1OC(C(O)C(O)C1O)c1c(O)c(C2OC(CO)C(O)C(O)C2O)c2occ(-c3ccc(O)cc3)c(=O)c2c1O
MCULE-5134512966 0.96 C(O)(=O)C=CC1C=CC(=C(OC)C=1)OC
MCULE-4648711215 0.96 C1=C(OC)C(OC)=CC(/C=C/C(=O)O)=C1
MCULE-4571364221 0.95 COC1=C(O)C=C(C=CC(O)=O)C=C1
MCULE-7013523945 0.95 C1=C(OC)C(O)=CC(=C1)/C=C/C(=O)O
MolPort-027-947-859 0.94 COc1ccc(cc1)-c1coc2c([C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)c(O)ccc2c1=O
MolPort-008-155-941 0.94 OC[C@H]1O[C@H]([C@H](O)[C@@H](O)[C@@H]1O)c1c(O)ccc2c1occ(-c1ccc(O)c(O)c1)c2=O
MolPort-027-947-859 0.94 COc1ccc(cc1)-c1coc2c([C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)c(O)ccc2c1=O
MCULE-1335506941 0.93 COC1C(O)=C(OC)C=C(/C=C/C(=O)O)C=1
MCULE-1297302420 0.93 C(=CC1C=CC(O)=C(OC)C=1)C(OC)=O
MCULE-7084750759 0.93 C1(=C(C=CC(=C1)/C=C/C(=O)OC)O)OC
MCULE-6112659813 0.93 COC1=C(O)C(OC)=CC(C=CC(O)=O)=C1
MCULE-5752702758 0.93 C(O)(=O)C=CC1=CC=CC(OC)=C1
MCULE-4807121652 0.93 C1(O)=C(C)C=C(C=C1OC)C([H])=C([H])C(O)=O
MCULE-3283632849 0.92 C(C)(C(O)=O)=CC1C=CC(=C(OC)C=1)OC
MCULE-2994486927 0.90 C(=C/C1C=CC(=C(OC)C=1)OC)\C(OC)=O
MolPort-039-337-151 0.90 COc1cc(ccc1O)-c1coc2c([C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)c(O)ccc2c1=O
MolPort-039-337-151 0.90 COc1cc(ccc1O)-c1coc2c([C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)c(O)ccc2c1=O
MCULE-4743217929 0.90 C1(=C(C=CC(=C1)C=CC(=O)OCC)O)OC
MCULE-8928982037 0.90 C1(OC)C=C(/C=C/C(=O)OCC)C=CC=1O
MCULE-9574272269 0.90 O=C(/C=C/C1C(O)=C(OC)C=CC=1)O
MCULE-9669475860 0.90 C1(OC)C(OC)=CC(=CC=1OC)C=CC(O)=O
MCULE-1947701492 0.90 C(=CC1C=CC(=C(OC)C=1)OC)C(OC)=O
MCULE-6800666719 0.90 C(O)(=O)C=CC1C=CC(=C(OC)C=1)OCC
MCULE-8351376607 0.90 C1(OC)C(OC)=CC(=CC=1OC)/C=C/C(O)=O
MCULE-7768753045 0.89 [Na+].C1(OC)=CC(=CC(OC)=C1OC)C=CC([O-])=O
MCULE-3227837163 0.89 O=C(/C=C/C1C=C(OC)C(O)=CC=1)OC(C)C
MCULE-3201962056 0.89 CCOC1=C(OC)C=CC(C=CC(O)=O)=C1
MCULE-9156764072 0.89 C(O)(=O)C=CC1=CC=C(C(OCC)=C1)OCC
MCULE-2157553829 0.89 C(=O)C=CC1=CC=C(O)C(OC)=C1
MCULE-2542199611 0.89 C1(C=CC(=CC=1OC)C=CC(O)=O)OC(C)C
MCULE-7395128935 0.89 C1(OC)C=C(/C=C/C=O)C=CC=1O
MolPort-039-339-139 0.88 OC[C@@]1(O)CO[C@@H](OC[C@H]2O[C@H]([C@H](O)[C@@H](O)[C@@H]2O)c2c(O)ccc3c2occ(-c2ccc(O)cc2)c3=O)[C@@H]1O
MolPort-039-339-141 0.88 O[C@@H]1CO[C@@H](OC[C@H]2O[C@H]([C@H](O)[C@@H](O)[C@@H]2O)c2c(O)ccc3c2occ(-c2ccc(O)cc2)c3=O)[C@H](O)[C@H]1O
MolPort-039-339-139 0.88 OC[C@@]1(O)CO[C@@H](OC[C@H]2O[C@H]([C@H](O)[C@@H](O)[C@@H]2O)c2c(O)ccc3c2occ(-c2ccc(O)cc2)c3=O)[C@@H]1O
MolPort-039-339-141 0.88 O[C@@H]1CO[C@@H](OC[C@H]2O[C@H]([C@H](O)[C@@H](O)[C@@H]2O)c2c(O)ccc3c2occ(-c2ccc(O)cc2)c3=O)[C@H](O)[C@H]1O
MCULE-4680058595 0.88 COC1=CC(C=C(C(O)=O)C)=CC=C1
MCULE-7533572392 0.88 C(=CC1C=CC(=C(O)C=1)OC)C(OC)=O
MCULE-5757199598 0.88 C1(O)C=C(/C=C/C(=O)OC)C=CC=1OC
MCULE-2475786053 0.88 O=C(/C=C/C1C=C(OC)C=C(O)C=1)O
MCULE-9498783535 0.88 C(O)(=O)C=CC1C=CC=C(OCC)C=1
MolPort-020-005-868 0.87 OC[C@H]1O[C@H]([C@H](O)[C@@H](O)[C@@H]1O)c1c(O)cc(O)c2c1oc1cc(O)c(O)cc1c2=O
MolPort-039-339-101 0.87 OC[C@H]1O[C@H]([C@H](O)[C@@H](O)[C@@H]1O)c1c(O)cc(O)c2c1oc1ccc(O)cc1c2=O
MolPort-020-005-868 0.87 OC[C@H]1O[C@H]([C@H](O)[C@@H](O)[C@@H]1O)c1c(O)cc(O)c2c1oc1cc(O)c(O)cc1c2=O
MolPort-039-339-101 0.87 OC[C@H]1O[C@H]([C@H](O)[C@@H](O)[C@@H]1O)c1c(O)cc(O)c2c1oc1ccc(O)cc1c2=O
MCULE-2906396849 0.87 O=C(/C=C/C1C=C(OC)C(O)=C(OC)C=1)OC
MCULE-6737978532 0.87 OC/C=C/C1=CC(OC)=C(O)C=C1
MCULE-5569913016 0.87 C1(OC)=CC(=CC=C1O)C=CCO
MCULE-6911603172 0.87 C1=C(OC)C(=CC(C=CC(=O)O)=C1)OC(C)C
MCULE-4524676206 0.87 C1(C=CC(=CC=1OCC)C=CC(O)=O)OC(C)C
MCULE-7925803308 0.87 C(=CC1C=CC(=C(OC)C=1)OC)C(OCC)=O
MCULE-8675181272 0.86 O=C(/C=C/C1C=C(OC)C(O)=CC=1)OC/C=C/C1C=C(OC)C(O)=CC=1
MCULE-2740776573 0.86 C(O)(=O)C=CC1C=C(OC)C=C(OC)C=1
MCULE-5655529420 0.86 C1C=C(C=C(C)C(=O)O)C=C(OC)C=1OC(C)C
MCULE-3302207880 0.86 C1(O)=CC=C(C=CC(=O)OCC=CC2C=CC(O)=C(OC)C=2)C=C1OC
MCULE-2800917117 0.86 C(O)(=O)C=CC1=CC=CC(OC(C)C)=C1
MCULE-5938473801 0.86 C(OC(C)C)(=O)C=CC1=CC=C(C(OC)=C1)OC
MCULE-3333629868 0.86 C(O)(=O)/C=C/C1C=C(OC)C=C(OC)C=1
MCULE-9394957877 0.86 C(=CC1C=CC=C(OC)C=1)C(OC)=O
MCULE-7843599914 0.85 C(O)(=O)/C=C/C1=CC=C(C(O)=C1)O
MCULE-5863166290 0.85 C1(OC)=C(O)C(OC)=CC(/C=C/C(=O)OCC)=C1
MCULE-8435564843 0.85 CCOC1=C(OC)C=C(C=CC(OC)=O)C=C1
MCULE-6770320666 0.85 C1(OC)=C(OC)C=C(C=C1OC)C=CC(OC)=O
MCULE-2069871168 0.85 C(O)(=O)C=CC1=CC=C(C(O)=C1)O
MCULE-1193790219 0.85 OC(C=CC1=CC(OC2=CC=CC=C2)=CC=C1)=O
MCULE-3421702175 0.85 C1(OC)=C(OC)C(=CC(/C=C/C(=O)OC)=C1)OC
MCULE-9748274284 0.85 C(O)(=O)C=CC1=CC(OC)=C(O)C(C=CC2=CC=C(O)C(OC)=C2)=C1
MCULE-2705718395 0.85 COC1=C(OCC=C)C=CC(C=CC(O)=O)=C1
MCULE-8291716022 0.85 C1(O)C=C(/C=C/C(=O)OCC)C=CC=1OC
MolPort-046-790-481 0.85 COc1ccc(cc1)-c1coc2c([C@@H]3O[C@H](CO[C@@H]4OC[C@](O)(CO)[C@H]4O)[C@@H](O)[C@H](O)[C@H]3O)c(O)ccc2c1=O
MolPort-046-790-410 0.85 OC[C@@]1(O)CO[C@@H](OC[C@H]2O[C@H]([C@H](O)[C@@H](O)[C@@H]2O)c2c(O)ccc3c2occ(-c2ccc(O)c(O)c2)c3=O)[C@@H]1O
MolPort-046-790-481 0.85 COc1ccc(cc1)-c1coc2c([C@@H]3O[C@H](CO[C@@H]4OC[C@](O)(CO)[C@H]4O)[C@@H](O)[C@H](O)[C@H]3O)c(O)ccc2c1=O
MolPort-046-790-410 0.85 OC[C@@]1(O)CO[C@@H](OC[C@H]2O[C@H]([C@H](O)[C@@H](O)[C@@H]2O)c2c(O)ccc3c2occ(-c2ccc(O)c(O)c2)c3=O)[C@@H]1O
MCULE-7411005425 0.85 CCOC(C=CC1=CC(OC)=C(O)C(OC)=C1)=O
MCULE-2540308957 0.84 C1(OC)C=C(/C=C/CO)C=CC=1OC
MCULE-3707127511 0.84 C(C1=CC=CC(OC)=C1OC)=CC(O)=O
MCULE-4456423689 0.84 C(O)(=O)C=CC1=CC=C(C=C1)OC
MCULE-6993960877 0.84 C(O)(=O)/C=C/C1=CC=C(C=C1)OC
MCULE-3675481473 0.84 O=C(/C=C/C1C(O)=CC=C(OC)C=1)O
MCULE-6132995974 0.84 CCOC(C=CC1=CC(OC)=CC=C1)=O
MCULE-9358125704 0.83 C1(OC)=C(OC)C=CC(C=C(C)C=O)=C1
MCULE-1823540360 0.83 C12C=C(C=CC=1OCO2)C=CC(O)=O
MCULE-7281458869 0.83 COC1C=C(/C=C(\C(=O)O)/C#N)C=CC=1O
MCULE-3982495166 0.83 COC(C=CC1=CC(OC)=C(OC(C)C)C=C1)=O
MCULE-1246916047 0.83 C(S)(C(O)=O)=CC1=CC=C(C(OC)=C1)O
MCULE-9512039229 0.83 CCCOC1=C(OC)C=C(C=CC(O)=O)C=C1
MCULE-8896300970 0.83 COC1=C(OC(F)F)C=CC(C=CC(O)=O)=C1
MCULE-9018774008 0.83 COC1=C(O)C=CC(C=C(C(O)=O)C#N)=C1
MCULE-4173386108 0.83 COC1=C(OCC(C)C)C=CC(C=CC(O)=O)=C1
MCULE-6022384798 0.83 C1(OC)C=C(/C=C/COC)C=CC=1O
MCULE-4602416073 0.83 C12C=C(C=CC=1OCO2)/C=C/C(O)=O
MCULE-7562503053 0.83 C1(OC)C=C(/C=C/C=O)C=C(OC)C=1O
MCULE-8633885216 0.83 C(O)(=O)C=CC1C=CC(=C(OCC)C=1)OCCO
MCULE-1224444606 0.83 C(=O)C=CC1=CC(OC)=C(O)C(OC)=C1
MCULE-1562931521 0.83 CCOC1=C(OCC)C=C(C=CC(OC)=O)C=C1
MolPort-003-935-138 0.82 OC[C@H]1O[C@H]([C@H](O)[C@@H](O)[C@@H]1O)c1c(O)cc(O)c2c1oc(cc2=O)-c1ccc(O)cc1
MCULE-8327329692 0.82 COC1=C(OCC#N)C=CC(C=CC(O)=O)=C1
MCULE-4356575066 0.82 C1(OC)C=C(/C=C/C(=O)C)C=CC=1O
MCULE-8539249453 0.82 C1(OC)C=CC(C=CC(=O)O)=C(C)C=1
MCULE-6395759770 0.82 C1(=CC=C(C=C1OC)C=CC(O)=O)OC(C)=O
MCULE-4446938280 0.82 OC1C(OC)=CC=C(/C=C/CO)C=1
MCULE-4113907065 0.82 C(=CC1=CC=CC(OCC)=C1)C(OC)=O
MCULE-1952313672 0.82 C12C=CC=CC=1C(=CC=C2C=CC(O)=O)OC
MCULE-6423120733 0.82 COC1C(O)=CC(C=CCO)=CC=1
MCULE-5234076176 0.82 CCOC(C=CC1=CC(OC)=C(OCC)C=C1)=O
MCULE-5099425428 0.82 C1(OC)C(OC)=CC(/C=C(/C(=O)O)\C(=O)O)=CC=1OC
MCULE-6563838758 0.82 C(O)(=O)C=CC1=CC=CC(=C1)OCC(C)C
MCULE-5911864609 0.82 C1(OCC)C(OCC)=CC(=CC=1OCC)C=CC(O)=O
MCULE-4155152948 0.82 CCOC1=C(OCC(C)C)C=CC(C=CC(O)=O)=C1
MCULE-3501590803 0.82 C1=C(O)C(OC)=CC(C=CC(=O)C)=C1
MCULE-1608251119 0.82 COC1=CC(C(C)=CC(O)=O)=CC=C1
MCULE-1020435052 0.82 CCCOC1=C(OCC)C=C(C=CC(O)=O)C=C1
MolPort-046-790-419 0.81 COc1cc(ccc1O)-c1coc2c([C@@H]3O[C@H](CO[C@@H]4OC[C@](O)(CO)[C@H]4O)[C@@H](O)[C@H](O)[C@H]3O)c(O)ccc2c1=O
MolPort-046-790-419 0.81 COc1cc(ccc1O)-c1coc2c([C@@H]3O[C@H](CO[C@@H]4OC[C@](O)(CO)[C@H]4O)[C@@H](O)[C@H](O)[C@H]3O)c(O)ccc2c1=O
MCULE-9923599536 0.81 C1(O)=C(OC)C=C(C=C1Cl)C=CC(O)=O
MCULE-3177958212 0.81 C(COC1C=CC(=CC=1OC)C=CC(O)=O)#C
MCULE-4516339720 0.81 OC(/C=C/C1C=CC=C(OC(F)(F)F)C=1)=O
MCULE-4825386658 0.81 C(=CC1=CC=C(C(O)=C1)O)C(OC)=O
MCULE-3749508872 0.81 C1(OC)=C(OC)C=CC(=C1OC)C=CC(O)=O
MCULE-9284982880 0.81 C(O)(=O)/C=C/C1=CC=C(C=C1)OCC
MCULE-3375513396 0.81 C(F)(F)(F)OC1C=CC=C(C=1)C=CC(O)=O
MCULE-5170571415 0.81 COC1=C(OC(C)C)C=CC(C=CC(OC(C)C)=O)=C1
MCULE-1594342569 0.81 C(O)(=O)C=CC1=CC=C(C=C1)OCC
MCULE-1775190954 0.81 C1=CC(=C(OCCOC)C=C1C=CC(=O)O)OC
MCULE-7911662540 0.81 C(C)(=O)OC1=CC(C=CC(O)=O)=CC=C1
MCULE-8431305757 0.81 C1(O)=C(OC)C=C(/C(/[H])=C(\[H])/CO)C=C1OC
MCULE-3430963805 0.81 C12C=C(C=CC=1OCCO2)C=CC(O)=O
MCULE-7815011628 0.81 CCOC(C=CC1=CC(OCC)=C(OCC)C=C1)=O
MCULE-4305805410 0.81 C(OC)(C=CC1C=C(OC)C=C(OC)C=1)=O
MCULE-5092485037 0.81 C(=CC(O)=O)C1=C(C)C=C(C=C1C)OC
MCULE-2489307192 0.81 C1(O)=C(OC)C=C(C([H])=C([H])CO)C=C1OC
MCULE-5269580490 0.81 C1(=C(C=CC(=C1)/C=C/C(=O)OC)O)O
MCULE-2149754174 0.81 C1(=C(OC)C=CC(/C=C/C(=O)O)=C1OC)OC
MCULE-2331942805 0.81 C(C(O)=O)(=CC1C=CC(OC)=C(OC)C=1)C#N
MCULE-1438836201 0.81 O(C1=CC=CC(C=CC(O)=O)=C1)C(F)F
MCULE-8699918665 0.81 C(S)(C(O)=O)=CC1=CC=C(C(OC)=C1)OC
MCULE-5902675061 0.81 C(OC(C)C)(=O)C=CC1=CC=C(C(OC)=C1)OCC
MCULE-5384523851 0.81 CCOC(C=CC1=CC(OC)=C(OC(C)C)C=C1)=O
MCULE-6510749965 0.81 CCOC1=C(OCCOC2=CC=CC=C2)C=CC(C=CC(O)=O)=C1
MolPort-046-790-402 0.80 OC[C@H]1O[C@@H](Oc2ccc(cc2)-c2coc3c([C@@H]4O[C@H](CO[C@@H]5OC[C@](O)(CO)[C@H]5O)[C@@H](O)[C@H](O)[C@H]4O)c(O)ccc3c2=O)[C@H](O)[C@@H](O)[C@@H]1O
MolPort-046-790-402 0.80 OC[C@H]1O[C@@H](Oc2ccc(cc2)-c2coc3c([C@@H]4O[C@H](CO[C@@H]5OC[C@](O)(CO)[C@H]5O)[C@@H](O)[C@H](O)[C@H]4O)c(O)ccc3c2=O)[C@H](O)[C@@H](O)[C@@H]1O
MCULE-5531510358 0.80 C1(O)=C(OC)C=C(C=C1Br)C=CC(O)=O
MCULE-3020705351 0.80 C12=CC=CC=C1C(=CC=C2C=CC(O)=O)OCC
MCULE-2670327901 0.80 C(=CC(O)=O)C1=CC(OC)=CC=C1OC
MCULE-6769285431 0.80 C1(O)=C(OC)C=C(C=C1I)C=CC(O)=O
MCULE-3400598023 0.80 C(=CC1=CC=CC(OCC)=C1)C(OCC)=O
MCULE-2569094851 0.80 C(O)(=O)C=CC1C=CC=C(O)C=1
MCULE-4677720960 0.80 O(C)C1C=CC(OCCOC2C=CC(C=CC(=O)O)=CC=2OC)=CC=1
MCULE-1723949511 0.80 C(OC(C)C)(=O)C=CC1C=CC(=C(OCC)C=1)OCC
MCULE-3296279605 0.80 C(COC1C=C(C=CC=1OC)C=CC(O)=O)#C
MCULE-5006038728 0.80 C(O)(=O)/C=C/C1C=CC=C(O)C=1
MCULE-2785937678 0.80 C1(OC)C=C(/C=C/C=O)C=C(OC)C=1OC
MCULE-8465188057 0.80 C1C=CC(C=C(CC)C(=O)O)=CC=1OC
MCULE-7674649726 0.80 C(O)(=O)C=CC1C=CC(=CC=1)OC(C)C
MCULE-4514871088 0.80 O=C(/C=C/C1C=C(Br)C(O)=C(OC)C=1)O
MCULE-2527166131 0.80 C(=CC1C=CC=C(C=1)OC1=CC=CC=C1)C(OC)=O
MCULE-1057313976 0.80 C(C)(=CC1=CC=C(C=C1)OC)C(O)=O
MCULE-7444824438 0.80 C(C)(C(O)=O)=CC1C=CC2=C(OCO2)C=1
MCULE-9475615038 0.80 COCCOC1=CC(C=CC(O)=O)=CC=C1
MCULE-2560342671 0.80 C12C=C(C=CC=1OCO2)C=CC(OC)=O
MCULE-3047237533 0.80 COC(C=CC1=CC(OC)=C(OCCO)C=C1)=O
MCULE-3239458209 0.80 COC1=CC2=C(C=C(C=C2)C=CC(O)=O)C=C1
MolPort-039-338-796 0.79 OC[C@H]1O[C@H]([C@H](O)[C@@H](O)[C@@H]1O)c1c(O)c([C@@H]2OC[C@H](O)[C@H](O)[C@H]2O)c(O)c2c1oc(cc2=O)-c1ccccc1
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