TPCN05516
Name | 29-O-??-D-glucopyranosyl-3??,22??,24,29-tetrahydroxy-olean-12-ene |
Molecular Formula | C52H84O21 |
Molecular Weight | 1045.22 |
CAS Registry Number | 1427450-35-8 |
SMILES | CC1OC(OC2C(OC3C(OC4CCC5(C)C(CCC6(C)C5CC=C5C7CC(C)(C)CC(OC8OCC(O)C(O)C8O)C7(C)CCC56C)C4(C)CO)OC(C(=O)O)C(O)C3O)OCC(O)C2O)C(O)C(O)C1O |
Classify | Triterpenoids |
Content
Family | Species | Part | Content (%) | Reference | DOI |
---|---|---|---|---|---|
Fabaceae | Astragalus angustifolius | Whole plants | 0.000327% | Planta Med. 2012. 78, 720-729. | 10.1055/s-0031-1298337 |
Properties
HBA | 21 | HBD | 12 |
HeavyAtoms | 73 | AlogP | -0.19 |
TPSA | 333.67 | RotatableBonds | 10 |
FractionCSP3 | 0.94 | Rings | 9 |
AromaticRings | 0 | AliphaticRings | 9 |