| Phytochemical Name : Pelargonidin 3-O-galactoside |
| PCNDIDP0039 |
| Pubchem CID : 12302249 |
| Molecular formula: C21H21O10+ |
| Canonical SMILES : C1=CC(=CC=C1C2=[O+]C3=CC(=CC(=C3C=C2OC4C(C(C(C(O4)CO)O)O)O)O)O)O |
Synonymes : Pelargonidin 3-O-galactoside|pelargonidin glucoside|pelargonidin-3-O-glucoside|Pelargonidin-3-glucoside (M9)|CHEBI:176349|BDBM108034|DTXSID001341520|2-[5,7-dihydroxy-2-(4-hydroxyphenyl)chromenylium-3-yl]oxy-6-(hydroxymethyl)oxane-3,4,5-triol |
| Structure | |
| 3D structure | 2D structure |
 |
| Log Po/w (iLOGP) : -2.090 |
| Log Po/w (XLOGP3) : 0.490 |
| Log Po/w (WLOGP) : 0.680 |
| Log Po/w (MLOGP) : -1.270 |
| Log Po/w (SILICOS-IT) : -1.440 |
| Consensus Log Po/w : -0.730 |