| Phytochemical Name : Sigmoidin B |
| PCNDIDS0105 |
| Pubchem CID : 73205 |
| Molecular formula: C20H20O6 |
| Canonical SMILES : CC(=CCC1=C(C(=CC(=C1)C2CC(=O)C3=C(C=C(C=C3O2)O)O)O)O)C |
Synonymes : Sigmoidin B|87746-47-2|Sigmoidin-B|CHEMBL229454|CHEBI:66483|(2S)-2-[3,4-dihydroxy-5-(3-methylbut-2-enyl)phenyl]-5,7-dihydroxy-2,3-dihydrochromen-4-one|(S)-2-(3,4-Dihydroxy-5-(3-methylbut-2-en-1-yl)phenyl)-5,7-dihydroxychroman-4-one|(2s)-2-[3,4-dihydroxy-5-(3-methylbut-2-en-1-yl)phenyl]-5,7-dihydroxy-2,3-dihydro-4h-chromen-4-one|D09HAX|DTXSID60236606|BDBM50212399|XS161553|5,7,3',4'-tetrahydroxy-5'-prenylflavone|Q27135084|(2S)-2-[3,4-dihydroxy-5-(3-methylbut-2-enyl)phenyl]-5,7-dihydroxy-chroman-4-one|(2S)- 2-(3,4-dihydroxy-5-(3-methyl-2-butenyl)phenyl)-2,3-dihydro-5,7-dihydroxy-4H-1-benzopyran-4-one|(2s)-2-[3,4-dihydroxy-5-(3-methylbut-2-en-1-yl)phenyl]-5,7-dihydroxy-3,4-dihydro-2h-1-benzopyran-4-one|4H-1-Benzopyran-4-one, 2-(3,4-dihydroxy-5-(3-methyl-2-butenyl)phenyl)-2,3-dihydro-5,7-di- hydroxy-, (S)-|4H-1-Benzopyran-4-one, 2-(3,4-dihydroxy-5-(3-methyl-2-butenyl)phenyl)-2,3-dihydro-5,7-dihydroxy-, (S)- |
| Structure | |
| 3D structure | 2D structure |
 |
| Log Po/w (iLOGP) : 2.630 |
| Log Po/w (XLOGP3) : 3.950 |
| Log Po/w (WLOGP) : 3.400 |
| Log Po/w (MLOGP) : 1.280 |
| Log Po/w (SILICOS-IT) : 3.270 |
| Consensus Log Po/w : 2.900 |