| Phytochemical Name : Oleanoside E |
| PCNDIDO0017 |
| Pubchem CID : 197091 |
| Molecular formula: C47H74O18 |
| Canonical SMILES : CC1(CCC2(CCC3(C(=CCC4C3(CCC5C4(CCC(C5(C)C)OC6C(C(C(C(O6)C(=O)O)OC7C(C(C(O7)CO)O)O)O)O)C)C)C2C1)C)C(=O)OC8C(C(C(C(O8)CO)O)O)O)C |
Synonymes : Oleanoside E|Araloside|Chikusetsusaponin 4|Chikusetsusaponin IV|(2S,3S,4R,5R,6S)-6-[[(6aR,6bS,8aS,12aR,14bR)-4,4,6a,6b,11,11,14b-heptamethyl-8a-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxycarbonyl-1,2,3,4a,5,6,7,8,9,10,12,12a,14,14a-tetradecahydropicen-3-yl]oxy]-3-[(2S,3R,4R,5S)-3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]oxy-4,5-dihydroxyoxane-2-carboxylic acid|beta-D-Glucopyranosiduronic acid, (3beta)-28-(beta-D-glucopyranosyloxy)-28-oxoolean-12-en-3-yl 4-O-alpha-L-arabinofuranosyl-|7518-22-1|32BF7Y358G|UNII-32BF7Y358G|LS-52965 |
| Structure | |
| 3D structure | 2D structure |
 |
| Log Po/w (iLOGP) : 3.210 |
| Log Po/w (XLOGP3) : 2.810 |
| Log Po/w (WLOGP) : 0.870 |
| Log Po/w (MLOGP) : -0.850 |
| Log Po/w (SILICOS-IT) : -0.170 |
| Consensus Log Po/w : 1.170 |