TPCN05367
| Name | Olean-12-en-28-oic acid, 3-[(O-??-D-glucopyranosyl-(1??3)-O-6-deoxy-??-L-mannopyranosyl-(1??2)-??-L-arabinopyranosyl)oxy]-, O-??-D-glucopyranosyl-(1??3)-O-6-deoxy-??-L-mannopyranosyl-(1??4)-O-??-D-glucopyranosyl-(1??6)-??-D-glucopyranosyl ester, (3??)- (9CI) |
| Molecular Formula | C71H116O35 |
| Molecular Weight | 1529.67 |
| CAS Registry Number | 261767-90-2 |
| SMILES | CC1OC(OC2C(CO)OC(OCC3OC(OC(=O)C45CCC(C)(C)CC4C4=CCC6C7(C)CCC(OC8OCC(O)C(O)C8OC8OC(C)C(O)C(OC9OC(CO)C(O)C(O)C9O)C8O)C(C)(C)C7CCC6(C)C4(C)CC5)C(O)C(O)C3O)C(O)C2O)C(O)C(OC2OC(CO)C(O)C(O)C2O)C1O |
| Classify | Triterpenoids |
Content
| Family | Species | Part | Content (%) | Reference | DOI |
|---|---|---|---|---|---|
| Araliaceae | Trevesia palmata | Leaves | 0.002375% | J Nat Prod. 2000. 63, 308-314 | 10.1021/np990231n |
Properties
| HBA | 35 | HBD | 20 |
| HeavyAtoms | 106 | AlogP | -5.87 |
| TPSA | 550.89 | RotatableBonds | 18 |
| FractionCSP3 | 0.96 | Rings | 12 |
| AromaticRings | 0 | AliphaticRings | 12 |