| Phytochemical Name : Gancaonin B |
| PCNDIDG0031 |
| Pubchem CID : 5317479 |
| Molecular formula: C21H20O6 |
| Canonical SMILES : CC(=CCC1=C(C2=C(C=C1O)OC=C(C2=O)C3=CC(=C(C=C3)OC)O)O)C |
Synonymes : Gancaonin B|124596-86-7|5,7,3'-Trihydroxy-4'-methoxy-6-prenylisoflavone|5,7-Dihydroxy-3-(3-hydroxy-4-methoxy-phenyl)-6-(3-methyl-but-2-enyl)-1-benzopyran-4-one|5,7-dihydroxy-3-(3-hydroxy-4-methoxyphenyl)-6-(3-methylbut-2-enyl)chromen-4-one|SCHEMBL1170939|DTXSID60154437|CHEBI:175730|LMPK12050262|3',5,7-Trihydroxy-4'-methoxy-6-prenylisoflavone|5,7-dihydroxy-3-(3-hydroxy-4-methoxy-phenyl)-6-(3-methylbut-2-enyl)chromen-4-one|5,7-Dihydroxy-3-(3-hydroxy-4-methoxyphenyl)-6-(3-methylbut-2-en-1-yl)-4H-chromen-4-one |
| Structure | |
| 3D structure | 2D structure |
 |
| Log Po/w (iLOGP) : 3.560 |
| Log Po/w (XLOGP3) : 4.560 |
| Log Po/w (WLOGP) : 4.090 |
| Log Po/w (MLOGP) : 1.310 |
| Log Po/w (SILICOS-IT) : 4.280 |
| Consensus Log Po/w : 3.560 |