TPCN05292
Name | Olean-12-en-28-oic acid, 3-[(O-??-D-glucopyranosyl-(1??3)-O-6-deoxy-??-L-mannopyranosyl-(1??2)-??-L-arabinopyranosyl)oxy]-16-hydroxy-, O-6-deoxy-??-L-mannopyranosyl-(1??4)-O-??-D-glucopyranosyl-(1??6)-??-D-glucopyranosyl ester, (3??,16??)- (9CI, ACI) |
Molecular Formula | C65H106O31 |
Molecular Weight | 1383.53 |
CAS Registry Number | 261767-94-6 |
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)CC5O)C(O)C(O)C3O)C(O)C2O)C(O)C(O)C1O |
Classify | Triterpenoids |
Content
Family | Species | Part | Content (%) | Reference | DOI |
---|---|---|---|---|---|
Araliaceae | Trevesia palmata | Leaves | 0.007750% | J Nat Prod. 2000. 63, 308-314 | 10.1021/np990231n |
Properties
HBA | 31 | HBD | 18 |
HeavyAtoms | 96 | AlogP | -4.72 |
TPSA | 491.97 | RotatableBonds | 15 |
FractionCSP3 | 0.95 | Rings | 11 |
AromaticRings | 0 | AliphaticRings | 11 |