SANC00857 Daidzin




Analog ID Similarity score SMILES

Selection options

Mcule | MolPort | All | None
MCULE-9661651155 1 C1(C2C=CC(=CC=2)O)=COC2C(=CC=C(C=2)O[C@@H]2O[C@H](CO)[C@H]([C@H](O)[C@H]2O)O)C1=O
MCULE-3802707688 1 C1(=CC=C(C=C1)O)C1=COC2C(=CC=C(C=2)OC2C(O)C(O)C(O)C(CO)O2)C1=O
MCULE-3986261063 1 OC1C=CC(C2=COC3C(=CC=C(C=3)O[C@H]3[C@H](O)[C@@H](O)[C@H](O)[C@@H](CO)O3)C2=O)=CC=1
MCULE-5020661304 0.99 C1=C(O[C@H]2[C@H](O)[C@@H](O)[C@H](O)[C@@H](CO)O2)C=C2C(C(C(C3=CC=C(OC)C=C3)=CO2)=O)=C1
MCULE-5104743671 0.99 C1(C2=CC=C(C=C2)OC)=COC2=C(C=CC(=C2)OC2OC(CO)C(C(O)C2O)O)C1=O
MCULE-6322088798 0.99 O(C1C=C2OC=C(C3C=CC(O[C@H]4[C@@H]([C@@H]([C@@H](O)[C@@H](O4)C)O)O)=CC=3)C(=O)C2=CC=1)[C@H]1[C@H](O)[C@H](O)[C@H]([C@H](C)O1)O
MCULE-8467041658 0.98 C1(C2C=CC=CC=2)=COC2=C(C=CC(=C2)OC2OC(CO)C(C(O)C2O)O)C1=O
MCULE-4928389866 0.96 C1(=O)C(C2=CC=C(C=C2)OC2OC(CO)C(C(O)C2O)O)=COC2=CC(OC)=CC(O)=C12
MCULE-8347695400 0.96 [C@H]1(CO[C@@H]2OC[C@](O)(CO)[C@H]2O)O[C@@H](OC2C=C3OC=C(C4C=CC(OC)=CC=4)C(=O)C3=CC=2)[C@H](O)[C@@H](O)[C@@H]1O
MCULE-9785088399 0.96 C1(=O)C(C2C=CC(=CC=2)OC)=COC2C=C(O[C@@H]3O[C@H](CO)[C@H]([C@H](O)[C@H]3O)O)C=C(O)C1=2
MCULE-2845910629 0.96 C1(=O)C(C2=CC=C(C=C2)OC2OC(CO)C(C(O)C2O)O)=COC2C=C(OCC)C=C(O)C1=2
MCULE-5786116593 0.96 C1(O)C(O)C(O)C(OC1CO)OC1=CC(O)=C2C(=O)C(C3=CC=C(OC)C=C3)=COC2=C1
MCULE-9729494070 0.96 C1(O[C@H]2[C@H](O)[C@@H](O)[C@H](O)[C@@H](CO)O2)C=C2OC=C(C3C=CC(OC)=CC=3)C(=O)C2=C(O)C=1
MCULE-3462482152 0.96 C1C(=C2C(=O)C(C3C=CC(=CC=3)O)=COC2=CC=1O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O)O
MCULE-5852260433 0.96 O(C1C=CC(C2=COC3C(C2=O)=CC=C(O)C=3)=CC=1)[C@H]1[C@@H]([C@@H](O)[C@H](O)[C@@H](CO)O1)O
MCULE-2689331400 0.96 C12OC=C(C3C=CC(O)=CC=3)C(=O)C=1C(O)=CC(O[C@H]1[C@H](O)[C@H]([C@H](O)[C@@H](CO)O1)O)=C2
MCULE-5373874989 0.96 C1(=O)C(C2=CC=C(C=C2)O[C@@H]2O[C@H](CO)[C@H]([C@H](O)[C@H]2O)O)=COC2=CC(OC)=CC(O)=C12
MCULE-3953125819 0.96 [C@H]1(CO)O[C@@H](OC2C=C3OC=C(C4C=CC(O[C@@H]5O[C@H](CO)[C@@H](O)[C@H](O)[C@H]5O)=CC=4)C(=O)C3=C(O)C=2)[C@H](O)[C@@H](O)[C@@H]1O
MCULE-8291930792 0.95 C1(C2C=CC(=CC=2)Br)=COC2=C(C=CC(=C2)O[C@@H]2O[C@H](CO)[C@H]([C@H](O)[C@H]2O)O)C1=O
MCULE-6782749692 0.95 [C@]1(O)(CO)[C@@H](O)[C@@H](OC2C(OC3C=C4OC=C(C5C=CC(OC)=CC=5)C(C4=CC=3)=O)OC(CO)C(O)C2O)OC1
MCULE-7555688289 0.95 C1(=O)C(C2C=CC(=CC=2)OC2OC(CO)C(C(O)C2O)O)=COC2C=C(OCCCCCCCC)C=C(O)C1=2
MCULE-3711623788 0.95 C1(=O)C(C2C=CC(=CC=2)OC2OC(CO)C(C(O)C2O)O)=COC2C=C(O)C=C(O)C1=2
MCULE-6186688935 0.95 C1(=O)C(C2C=CC(=CC=2)O[C@@H]2O[C@H](CO)[C@H]([C@H](O)[C@H]2O)O)=COC2=CC(O)=CC(O)=C12
MCULE-4450230302 0.95 C1(C2=CC=C(C=C2)Br)=COC2=C(C=CC(=C2)OC2OC(CO)C(C(O)C2O)O)C1=O
MCULE-3087976761 0.95 C1(O)C=C2OC=C(C3C=CC(O[C@@H]4O[C@H](CO)[C@@H](O)[C@H](O)[C@H]4O)=CC=3)C(=O)C2=C(O)C=1
MCULE-7356674867 0.94 C1(=CC=C2C(=C1)OC=C(C2=O)C1C=CC(O)=C(OC)C=1)OC1OC(CO)C(O)C(O)C1O
MCULE-2177417619 0.94 O1C=C(C2C=CC(OC)=C(O)C=2)C(=O)C2=CC=C(O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)C=C12
MCULE-6863192479 0.94 C1(=CC=C2C(=C1)OC=C(C2=O)C1C=CC(OC)=C(O)C=1)O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O
MCULE-2933337352 0.94 C1(=O)C(C2=CC=C(C=C2)OC2OC(CO)C(C(O)C2O)O)=COC2=CC(OC)=CC(OC)=C12
MCULE-6041606508 0.94 C1(=CC(=C2C(=C1)OC=C(C2=O)C1C=CC(O)=CC=1)OC)O[C@H]1[C@H](O)[C@@H](O)[C@H](O)[C@@H](CO)O1
MCULE-2809671108 0.94 C1(O[C@H]2[C@H](O)[C@@H](O)[C@H](O)[C@@H](CO[C@H]3[C@H](O)[C@H](O)[C@@H](O)[C@H](C)O3)O2)C=C2OC=C(C3C=CC(O)=CC=3)C(=O)C2=C(O)C=1
MCULE-9504013462 0.93 C1(C=C2OC=C(C(C2=C(C=1)O)=O)C1C=CC(=CC=1)OC)OC1OC(COC2OC(C)C(O)C(O)C2O)C(O)C(O)C1O
MCULE-7991507158 0.93 [C@H]1(CO[C@@H]2OC[C@](O)(CO)[C@H]2O)O[C@@H](OC2C=C3OC=C(C4C=CC(O)=CC=4)C(=O)C3=C(O)C=2)[C@H](O)[C@@H](O)[C@@H]1O
MCULE-7543729081 0.92 C1(C2C=CC(=CC=2)Cl)=COC2=C(C=CC(=C2)O[C@@H]2O[C@H](CO)[C@H]([C@H](O)[C@H]2O)O)C1=O
MCULE-3723793024 0.92 C1(OC(C)=O)C(OC2C=CC3=C(OC=C(C4=CC=C(C=C4)OC)C3=O)C=2)OC(C(OC(C)=O)C1OC(C)=O)COC(C)=O
MCULE-5071737554 0.92 C1(O[C@H]2[C@H](O)[C@@H](O)[C@H](O)[C@@H](CO[C@H]3[C@H](O)[C@](CO[C@H]4[C@H](O)[C@](CO)(O)CO4)(O)CO3)O2)C=C2OC=C(C3C=CC(OC)=CC=3)C(=O)C2=C(O)C=1
MCULE-8946785681 0.92 C1(O)C=C2OC=C(C3C=CC(O[C@@H]4O[C@H](CO)[C@@H](O)[C@H](O)[C@H]4O[C@H]4[C@H](O)[C@H](O)[C@@H](O)[C@H](C)O4)=CC=3)C(=O)C2=C(O)C=1
MCULE-4743867472 0.92 COC1C=C(O)C=C(C2C(=O)C3C=CC(O[C@@H]4O[C@H](CO)[C@@H](O)[C@H](O)[C@H]4O)=CC=3OC=2)C=1
MCULE-3825359860 0.92 C1(C2=CC=C(C=C2)F)=COC2=C(C=CC(=C2)OC2OC(CO)C(C(O)C2O)O)C1=O
MCULE-5157793277 0.92 C1(C2C=CC(=CC=2)Cl)=COC2=C(C=CC(=C2)OC2([H])OC([H])(CO)C(C([H])(O)C2([H])O)([H])O)C1=O
MCULE-6321549053 0.91 C1C=C(O)C=CC=1C1=COC2C=C(O[C@H]3[C@H](O)[C@@H](O)[C@H](O)[C@@H](CO)O3)C(OC)=CC=2C1=O
MCULE-3742219449 0.91 C1(OC(C)=O)C(OC2C=CC3=C(OC=C(C4=CC=CC=C4)C3=O)C=2)OC(C(OC(C)=O)C1OC(C)=O)COC(C)=O
MCULE-4445557596 0.91 C1(O[C@H]2[C@H](O)[C@@H](O)[C@H](O)[C@@H](COC(CC(O)=O)=O)O2)C=C2OC=C(C3C=CC(O)=CC=3)C(=O)C2=CC=1
MCULE-5983299208 0.91 C1(C2=CC=C3C(OCCO3)=C2)=COC2=C(C=CC(=C2)OC2OC(CO)C(C(O)C2O)O)C1=O
MCULE-7326694429 0.91 C1(O[C@H]2[C@H](O)[C@@H](O)[C@H](O)[C@@H](CO)O2)C=C2OC=C(C3C=CC(O)=CC=3)C(=O)C2=CC=1OC
MCULE-8617779840 0.91 C1(C2C=CC=CC=2F)=COC2=C(C=CC(=C2)OC2OC(CO)C(C(O)C2O)O)C1=O
MCULE-7608953351 0.91 C1(=COC2=CC(=CC=C2C1=O)O[C@H]1[C@@H](O)[C@@H]([C@@H](O)[C@H](CO)O1)O)C1C=CC2OCCOC=2C=1
MCULE-2020129864 0.91 C1(C2C=CC3=C(OCCO3)C=2)=COC2=C(C=CC(=C2)O[C@@H]2O[C@H](CO)[C@H]([C@H](O)[C@H]2O)O)C1=O
MCULE-1342930058 0.90 O(C)C1C=CC(C2=COC3C(C2=O)=CC=C(O[C@@H]2O[C@H](COC(=O)CC(=O)O)[C@@H](O)[C@H](O)[C@H]2O)C=3)=CC=1
MCULE-1934559862 0.90 C1(C2C=CC3=C(OCCCO3)C=2)=COC2=C(C=CC(=C2)O[C@H]2O[C@@H](CO)[C@@H]([C@@H](O)[C@@H]2O)O)C1=O
MCULE-6903650142 0.88 [C@H]1(OC(C)=O)[C@H](OC2C=CC3=C(OC=C(C4C=CC(=CC=4)Br)C3=O)C=2)O[C@@H]([C@@H](OC(C)=O)[C@@H]1OC(C)=O)COC(C)=O
MCULE-5193336941 0.88 OC(=O)CC(=O)OC[C@@H]1[C@@H](O)[C@H](O)[C@@H](O)[C@H](OC2=CC(=C3C(=O)C(=COC3=C2)C2C=CC(O)=CC=2)O)O1
MCULE-8723502582 0.88 C1(O[C@H]2[C@H](O)[C@@H](O)[C@H](O)[C@@H](CO)O2)C=C2OC=C(C3C=CC(O)=CC=3)C(=O)C2=C(O)C=1OC
MCULE-6771018426 0.88 C1(O[C@H]2[C@H](O)[C@@H](O)[C@H](O)[C@@H](CO[C@H]3[C@H](O)[C@@H](O)[C@H](O)CO3)O2)C=C2OC=C(C3C=CC(OC)=CC=3)C(=O)C2=C(O)C=1O
MCULE-1787637134 0.88 C1(OC(C)=O)C(OC2C=CC3=C(OC=C(C4=CC=C(C=C4)Br)C3=O)C=2)OC(C(OC(C)=O)C1OC(C)=O)COC(C)=O
MCULE-7518275192 0.88 COC1C(O)=C2C(C(C3C=CC(O)=CC=3)=COC2=CC=1O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O)=O
MCULE-9394520882 0.87 [C@H]1(OC(C)=O)[C@H](OC2C=CC3=C(OC=C(C4C=CC5=C(OCCO5)C=4)C3=O)C=2)O[C@@H]([C@@H](OC(C)=O)[C@@H]1OC(C)=O)COC(C)=O
MCULE-5262383356 0.87 C12C=C(C(O[C@H]3[C@H](O)[C@H]([C@H](O)[C@@H](COC(=O)C)O3)O)=CC=1OC=C(C1=CC=C(O)C=C1)C2=O)OC
MCULE-7319200979 0.87 C1(OC(C)=O)C(OC2C=CC3=C(OC=C(C4C=CC5=C(OCCO5)C=4)C3=O)C=2)OC(C(OC(C)=O)C1OC(C)=O)COC(C)=O
MCULE-5669623639 0.87 O([C@H]1[C@H](O)[C@@H](O)[C@H](O)[C@@H](CO)O1)C1C=CC(C2=COC3C(C2=O)=C(C2OCOC=2C=3)OC)=CC=1
MCULE-7057789102 0.87 C1(=O)C(C2C=CC(=CC=2)OC2OC(CO)C(C(O)C2O)O)=COC2C=C(OC(CCCCCCC)C(OC)=O)C=C(O)C1=2
MCULE-5036867175 0.87 C1(O)C(C(O)=O)OC(OC2C=C3OC=C(C4C=CC(OC)=CC=4)C(=O)C3=C(O)C=2)C(O)C1O
MCULE-5985839421 0.86 C1(O[C@H]2[C@H](O)[C@@H](O)[C@H](O)[C@@H](CO[C@H]3[C@H](O)[C@@H](O)[C@H](O)CO3)O2)C=C2OC=C(C3C=CC(O)=CC=3)C(=O)C2=C(O)C=1OC
MCULE-6701339653 0.86 O([C@H]1[C@H](O)[C@@H](O)[C@H](O)[C@@H](C(O)=O)O1)C1C=CC(=CC=1)C1=COC2C(=C(C=C(C=2)O)O)C1=O
MCULE-6803897587 0.86 C1(OC(C)=O)C(OC2C=CC3=C(OC=C(C4=CC=C(C=C4)F)C3=O)C=2)OC(C(OC(C)=O)C1OC(C)=O)COC(C)=O
MCULE-1896487494 0.86 [C@H]1(OC(C)=O)[C@H](OC2C=CC3=C(OC=C(C4C=CC(=CC=4)Cl)C3=O)C=2)O[C@@H]([C@@H](OC(C)=O)[C@@H]1OC(C)=O)COC(C)=O
MCULE-6323465632 0.86 C1(OC(C)=O)C(OC2C=CC3=C(OC=C(C4=CC=C(C=C4)Cl)C3=O)C=2)OC(C(OC(C)=O)C1OC(C)=O)COC(C)=O
MCULE-7119811728 0.86 C1(OC(C)=O)C(OC2C=CC3=C(OC=C(C4C=CC5=C(OCCCO5)C=4)C3=O)C=2)OC(C(OC(C)=O)C1OC(C)=O)COC(C)=O
MCULE-5136402587 0.86 [C@]1(O)(CO)[C@@H](O)[C@@H](OC[C@@H]2[C@H]([C@@H]([C@@H](O)[C@H](OC3C=C4OC=C(C5C=CC(O)=CC=5)C(=O)C4=C(O)C=3OC)O2)O)O)OC1
MCULE-2953930604 0.85 C1(=O)C(C2=CC=C(C=C2)OC2O[C@@H](COC(C)=O)[C@@H]([C@@H](OC(C)=O)[C@@H]2OC(C)=O)OC(C)=O)=COC2C=C(OC(C)=O)C=C(OC(C)=O)C1=2
MCULE-2932688425 0.85 [C@@H]1(OC(=O)C)[C@@H](OC(=O)C)[C@@H](O[C@H](OC2C=CC(C3=COC4=CC(=CC(OC(=O)C)=C4C3=O)OC(=O)C)=CC=2)[C@H]1OC(=O)C)COC(=O)C
MCULE-4091860592 0.85 C1(=O)C(C2C=CC(=CC=2)OC2([H])OC([H])(COC(C)=O)C(C([H])(OC(C)=O)C2([H])OC(C)=O)([H])OC(C)=O)=COC2C=C(OC(C)=O)C=C(OC(C)=O)C1=2
MCULE-4593271206 0.85 C1(=O)C(C2=CC=C(C=C2)OC)=COC2C=C(O[C@@H]3O[C@H](COC(C)=O)[C@H]([C@H](OC(C)=O)[C@H]3OC(C)=O)OC(C)=O)C=C(OC(C)=O)C1=2
MCULE-5748274118 0.85 C1(C2C=CC=CC=2F)=COC2=C(C=CC(=C2)O[C@@H]2O[C@H](COC(C)=O)[C@H]([C@H](OC(C)=O)[C@H]2OC(C)=O)OC(C)=O)C1=O
MCULE-2050398838 0.85 C1(C2C=CC=CC=2F)=COC2=C(C=CC(=C2)OC2OC(COC(C)=O)C(C(OC(C)=O)C2OC(C)=O)OC(C)=O)C1=O
MCULE-6265007196 0.84 C1(C2C=CC3=C(OCCO3)C=2)=C(C)OC2=C(C=CC(=C2)OC2OC(CO)C(C(O)C2O)O)C1=O
MCULE-5011340610 0.84 O(C1C(O)C(O)C(O)C(COC2C(O)C(O)C(O)C(CO)O2)O1)C1C(=CC(C2=COC3C(C2=O)=C(C(O)=C(OC)C=3)OC)=CC=1)O
MCULE-8046903426 0.84 C1(=O)C(C2C=CC(=CC=2)OC2OC(COC(CCCCCN)=O)C(C(O)C2O)O)=COC2C=C(O)C=C(O)C1=2
MCULE-5780580181 0.84 OC1C(OCC2OC(OC3=C(OC)C=C(C4=COC5C(C4=O)=C(O)C=C(OC)C=5)C=C3)C(O)C(O)C2O)OCC1(O)CO
MCULE-2851676826 0.84 O(C1C(=CC(C2=COC3C(C2=O)=C(C(OC)=C(C=3)O[C@H]2[C@H](O)[C@@H](O)[C@H](O)[C@@H](CO)O2)O)=CC=1O)OC)C
MCULE-3974148349 0.84 C1(C2C=CC3=C(OCCO3)C=2)=C(C)OC2C(=CC=C(C=2)O[C@@H]2O[C@H](CO)[C@H]([C@H](O)[C@H]2O)O)C1=O
MCULE-9181397795 0.84 C1(=O)C(C2=CC=C(C=C2)Cl)=COC2C=C(OC3OC(COC(C)=O)C(C(OC(C)=O)C3OC(C)=O)OC(C)=O)C=C(O)C1=2
MCULE-3885032255 0.84 C1(C2C=CC3=C(OCCO3)C=2)=C(C)OC2=C(C=CC(=C2)O[C@H]2O[C@H](CO)[C@H]([C@H](O)[C@H]2O)O)C1=O
MCULE-6921702416 0.84 [C@H]1(CO[C@@H]2OC[C@](O)(CO)[C@H]2O)O[C@@H](OC2C(OC)=C3OC=C(C4C=CC(OC)=CC=4)C(=O)C3=CC=2)[C@H](O)[C@@H](O)[C@@H]1O
MCULE-1328032592 0.84 COC1C(OC)=C(O)C=C(C2C(=O)C3C(=CC(O[C@@H]4O[C@H](CO)[C@@H](O)[C@H](O)[C@H]4O)=C(OC)C=3O)OC=2)C=1
MCULE-9955648032 0.84 C1(O[C@H]2[C@H](O)[C@@H](O)[C@H](O)[C@@H](CO)O2)C=C2OC=C(C3C=C(O)C(OC)=CC=3)C(=O)C2=C(O)C=1OC
MCULE-8895000640 0.84 C1(=O)C(C2C=CC(=CC=2)OC2OC(COC(CCCCCN)=O)C(C(O)C2O)O)=COC2C=C(O)C=C(O)C1=2.Cl
MCULE-4172343198 0.83 C1(=O)[C@H](O)[C@@H](CO)O[C@@H](OC2C=CC3=C(OC=C(C4=CC=C(C=C4)F)C3=O)C=2)[C@@H]1O
MCULE-8240378346 0.83 C1(OC(C)=O)C(OC2=CC=C3C(=C2)C(=O)C(=CO3)C2C=CC(=CC=2)OC)OC(C(OC(C)=O)C1OC(C)=O)COC(C)=O
MCULE-4754188093 0.83 [C@]1(O)(CO)[C@@H](O)[C@@H](OC[C@@H]2[C@H]([C@H](O)[C@@H](O)[C@H](OC3=C(OC)C=C4C(=O)C(C5C=CC6OCOC=6C=5)=COC4=C3)O2)O)OC1
MCULE-4954035649 0.82 C12OC=C(C3C=CC(OC)=CC=3)C(=O)C=1C=CC(O)=C2O[C@H]1[C@H](O)[C@H]([C@H](O)[C@@H](CO)O1)O
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