TPCN05147
| Name | Oleanolic acid 28-O-??-L-rhamnopyranosyl-(1-->2)-[??-D-xylopyranosyl (l-->6)]-??-D-glucopyranosyl ester |
| Molecular Formula | C47H76O16 |
| Molecular Weight | 897.11 |
| CAS Registry Number | 933983-13-2 |
| SMILES | CC1OC(OC2C(OC(=O)C34CCC(C)(C)CC3C3=CCC5C6(C)CCC(O)C(C)(C)C6CCC5(C)C3(C)CC4)OC(COC3OCC(O)C(O)C3O)C(O)C2O)C(O)C(O)C1O |
| Classify | Triterpenoids |
Content
| Family | Species | Part | Content (%) | Reference | DOI |
|---|---|---|---|---|---|
| Caprifoliaceae | Lonicera japonica | Flowers | 0.000241% | Arch Pharm Res 30, 1-7 (2007) | 10.1007/bf02977770 |
Properties
| HBA | 16 | HBD | 9 |
| HeavyAtoms | 63 | AlogP | 1.81 |
| TPSA | 254.52 | RotatableBonds | 7 |
| FractionCSP3 | 0.94 | Rings | 8 |
| AromaticRings | 0 | AliphaticRings | 8 |