| Phytochemical Name : Peonidin |
| PCNDIDP0046 |
| Pubchem CID : 441773 |
| Molecular formula: C16H13O6+ |
| Canonical SMILES : COC1=C(C=CC(=C1)C2=[O+]C3=CC(=CC(=C3C=C2O)O)O)O |
Synonymes : Peonidin|CHEBI:75314|3,4',5,7-tetrahydroxy-3'-methoxyflavylium|peonidin cation|peonidin(1+)|SCHEMBL20017|2-(4-hydroxy-3-methoxyphenyl)chromenylium-3,5,7-triol|CHEMBL1277324|DTXSID80861792|BDBM50347140|LMPK12010006|Q3072948|3,5,7-Trihydroxy-2-(4-hydroxy-3-methoxyphenyl)-1-benzopyrylium |
| Structure | |
| 3D structure | 2D structure |
 |
| Log Po/w (iLOGP) : -1.940 |
| Log Po/w (XLOGP3) : 2.270 |
| Log Po/w (WLOGP) : 3.210 |
| Log Po/w (MLOGP) : 0.570 |
| Log Po/w (SILICOS-IT) : 0.760 |
| Consensus Log Po/w : 0.970 |