TPCN04290
Name | 16??,21??-Diacetoxy-22??-angeloyl28-hydroxyolean-12-ene 3-O-[??-rhamnopyranosyl-(1''''??6''')-??-glucopyranosyl-(1''' ?? 3')][??-glucopyranosyl-(1''?? 2')]-??-glucuronopyranoside |
Molecular Formula | C63H98O28 |
Molecular Weight | 1303.45 |
CAS Registry Number | 1460315-65-4 |
SMILES | CC=C(C)C(=O)OC1C(OC(C)=O)C(C)(C)CC2C3=CCC4C5(C)CCC(OC6OC(C(=O)O)C(O)C(OC7OC(COC8OC(C)C(O)C(O)C8O)C(O)C(O)C7O)C6OC6OC(CO)C(O)C(O)C6O)C(C)(C)C5CCC4(C)C3(C)CC(OC(C)=O)C21CO |
Classify | Triterpenoids |
Content
Family | Species | Part | Content (%) | Reference | DOI |
---|---|---|---|---|---|
Primulaceae | Maesa lanceolata | Woods | 0.002250% | J Asian Nat Prod Res 14(11): 987-1001. | 10.1080/10286020.2012.674302 |
Properties
HBA | 28 | HBD | 13 |
HeavyAtoms | 91 | AlogP | -0.87 |
TPSA | 432.80 | RotatableBonds | 16 |
FractionCSP3 | 0.87 | Rings | 9 |
AromaticRings | 0 | AliphaticRings | 9 |