TPCN04322
Name | 16??-Acetoxy-21??-hydroxy-22??-angeloyl-13??,28-oxydoolean-28??-ol 3-O-[??-rhamnopyranosyl-(1''''??6''')??-glucopyranosyl-(1''' ?? 4')] [??-glucopyranosyl-(1''?? 2')]??-arabinopyranoside |
Molecular Formula | C60H96O26 |
Molecular Weight | 1233.40 |
CAS Registry Number | 1460315-66-5 |
SMILES | CC=C(C)C(=O)OC1C(O)C(C)(C)CC2C13C(O)OC21CCC2C4(C)CCC(OC5OCC(O)C(OC6OC(COC7OC(C)C(O)C(O)C7O)C(O)C(O)C6O)C5OC5OC(CO)C(O)C(O)C5O)C(C)(C)C4CCC2(C)C1(C)CC3OC(C)=O |
Classify | Triterpenoids |
Content
Family | Species | Part | Content (%) | Reference | DOI |
---|---|---|---|---|---|
Primulaceae | Maesa lanceolata | Woods | 0.001750% | J Asian Nat Prod Res 14(11): 987-1001. | 10.1080/10286020.2012.674302 |
Properties
HBA | 26 | HBD | 13 |
HeavyAtoms | 86 | AlogP | -1.34 |
TPSA | 398.66 | RotatableBonds | 13 |
FractionCSP3 | 0.93 | Rings | 10 |
AromaticRings | 0 | AliphaticRings | 10 |