TPCN05344
Name | 3-O-[??-L-rhamnopyranosyl-(1 ?? 2)-??-D-glucopyranosyl]-16-O-hydroxyacetoxy-3??,6??,16??,23??,25-pentahydroxy-20(R),24(S)-epoxycycloartane |
Molecular Formula | C44H72O16 |
Molecular Weight | 857.04 |
CAS Registry Number | 1427450-27-8 |
SMILES | CC1OC(OC2C(OC3CCC45CC46CCC4(C)C(C7(C)CCC(C(C)(C)O)O7)C(OC(=O)CO)CC4(C)C6CC(O)C5C3(C)C)OC(CO)C(O)C2O)C(O)C(O)C1O |
Classify | Triterpenoids |
Content
Family | Species | Part | Content (%) | Reference | DOI |
---|---|---|---|---|---|
Fabaceae | Astragalus angustifolius | Whole plants | 0.003270% | Planta Med. 2012. 78, 720-729. | 10.1055/s-0031-1298337 |
Properties
HBA | 16 | HBD | 9 |
HeavyAtoms | 60 | AlogP | 0.66 |
TPSA | 254.52 | RotatableBonds | 9 |
FractionCSP3 | 0.98 | Rings | 8 |
AromaticRings | 0 | AliphaticRings | 8 |