| Phytochemical Name : Salireposide |
| PCNDIDS0016 |
| Pubchem CID : 117440 |
| Molecular formula: C20H22O9 |
| Canonical SMILES : C1=CC=C(C=C1)C(=O)OCC2=C(C=CC(=C2)O)OC3C(C(C(C(O3)CO)O)O)O |
Synonymes : salireposide|16955-55-8|YUB3J70275|Salireposid|UNII-YUB3J70275|CHEMBL464611|DTXSID60937646|CHEBI:137508|AKOS040753905|[5-hydroxy-2-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyphenyl]methyl benzoate|XS171863|[2-(Hexopyranosyloxy)-5-hydroxyphenyl]methyl benzoate|Q27294716|beta-D-Glucopyranoside, 2-((benzoyloxy)methyl)-4-hydroxyphenyl|.BETA.-D-GLUCOPYRANOSIDE, 2-((BENZOYLOXY)METHYL)-4-HYDROXYPHENYL|5-hydroxy-2-(((2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydro-2H-pyran-2-yl)oxy)benzyl benzoate |
| Structure | |
| 3D structure | 2D structure |
 |
| Log Po/w (iLOGP) : 3.160 |
| Log Po/w (XLOGP3) : 0.660 |
| Log Po/w (WLOGP) : -0.220 |
| Log Po/w (MLOGP) : -0.330 |
| Log Po/w (SILICOS-IT) : 0.220 |
| Consensus Log Po/w : 0.700 |