| Phytochemical Name : Hamamelofuranose 2'5'-digallate |
| PCNDIDH0002 |
| Pubchem CID : 44584241 |
| Molecular formula: C20H20O14 |
| Canonical SMILES : C1=C(C=C(C(=C1O)O)O)C(=O)OCC2C(C(C(O2)O)(COC(=O)C3=CC(=C(C(=C3)O)O)O)O)O |
Synonymes : Hamamelitannin|469-32-9|Hamamelofuranose 2'5'-digallate|Hamamelofuranose2,5-digallate|2',5-Digalloylhamamelofuranose|hamamelitanin|CHEMBL465414|CHEBI:191119|MFCD33023081|Q15632711|((2S,3S,4S)-3,4,5-trihydroxytetrahydrofuran-2,4-diyl)bis(methylene) bis(3,4,5-trihydroxybenzoate)|[(2S,3S,4S)-3,4,5-trihydroxy-4-[(3,4,5-trihydroxybenzoyl)oxymethyl]oxolan-2-yl]methyl 3,4,5-trihydroxybenzoate |
| Structure | |
| 3D structure | 2D structure |
 |
| Log Po/w (iLOGP) : 0.600 |
| Log Po/w (XLOGP3) : -1.050 |
| Log Po/w (WLOGP) : -1.260 |
| Log Po/w (MLOGP) : -2.300 |
| Log Po/w (SILICOS-IT) : -1.520 |
| Consensus Log Po/w : -1.110 |