| Phytochemical Name : Divanillalaceton |
| PCNDIDD0162 |
| Pubchem CID : 468133 |
| Molecular formula: C19H18O5 |
| Canonical SMILES : COC1=C(C=CC(=C1)C=CC(=O)C=CC2=CC(=C(C=C2)O)OC)O |
Synonymes : Divanillalaceton|1,5-Bis(4-hydroxy-3-methoxyphenyl)-1,4-pentadien-3-one|1,5-bis(4-hydroxy-3-methoxyphenyl)-penta 1,4-dien-3-one |
| Structure | |
| 3D structure | 2D structure |
 |
| Log Po/w (iLOGP) : 3.610 |
| Log Po/w (XLOGP3) : 6.170 |
| Log Po/w (WLOGP) : 6.240 |
| Log Po/w (MLOGP) : 4.730 |
| Log Po/w (SILICOS-IT) : 6.240 |
| Consensus Log Po/w : 5.400 |