| Phytochemical Name : Gingerenone A |
| PCNDIDG0069 |
| Pubchem CID : 5281775 |
| Molecular formula: C21H24O5 |
| Canonical SMILES : COC1=C(C=CC(=C1)CCC=CC(=O)CCC2=CC(=C(C=C2)O)OC)O |
Synonymes : Gingerenone A|128700-97-0|(E)-1,7-bis(4-hydroxy-3-methoxyphenyl)hept-4-en-3-one|1,7-bis(4-hydroxy-3-methoxyphenyl)hept-4-en-3-one|AS-HK014|CHEBI:5352|4-Hepten-3-one, 1,7-bis(4-hydroxy-3-methoxyphenyl)-, (4E)-|79067-88-2|4-Hepten-3-one, 1,7-bis(4-hydroxy-3-methoxyphenyl)-|(4E)-1,7-Bis(4-hydroxy-3-methoxyphenyl)-4-hepten-3-one|(E)-Gingerenone A|Gingerone A|C10460|SCHEMBL4740686|CHEMBL1086746|DTXSID50873741|AC-36929|Q27106727|(4E)-1,7-bis(4-hydroxy-3-methoxyphenyl)hept-4-en-3-one|(E)-1,7-bis(4-hydroxy-3-methoxy-phenyl)hept-4-en-3-one|1,7-Bis(4-hydroxy-3-methoxyphenyl)-4-hepten-3-one, 9CI|4-Hepten-3-one, 1,7-bis(4-hydroxy-3-methoxyphenyl)-, (E)- |
| Structure | |
| 3D structure | 2D structure |
 |
| Log Po/w (iLOGP) : 3.600 |
| Log Po/w (XLOGP3) : 3.740 |
| Log Po/w (WLOGP) : 3.810 |
| Log Po/w (MLOGP) : 2.440 |
| Log Po/w (SILICOS-IT) : 4.660 |
| Consensus Log Po/w : 3.650 |