TPCN05385
Name | 3-O-[??-L-rhamnopyranosyl-(1 ?? 2)-??-D-glucopyranosyl]-16-O-hydroxyacetoxy-3??,6??,16??,25-tetrahydroxy-20(R),24(S)-epoxycycloartane |
Molecular Formula | C51H80O21 |
Molecular Weight | 1029.18 |
CAS Registry Number | 156025-58-0 |
SMILES | CC1OC(OC2CCC3(C)C(CCC4(C)C3C=CC35OCC6(CCC(C)(C)CC63)C(O)CC45C)C2(C)CO)C(OC2OC(COC(=O)CC(=O)O)C(O)C(O)C2O)C(OC2OC(CO)C(O)C(O)C2O)C1O |
Classify | Triterpenoids |
Content
Family | Species | Part | Content (%) | Reference | DOI |
---|---|---|---|---|---|
Fabaceae | Astragalus angustifolius | Whole plants | 0.001907% | Planta Med. 2012. 78, 720-729. | 10.1055/s-0031-1298337 |
Properties
HBA | 21 | HBD | 11 |
HeavyAtoms | 72 | AlogP | -0.37 |
TPSA | 330.51 | RotatableBonds | 12 |
FractionCSP3 | 0.92 | Rings | 9 |
AromaticRings | 0 | AliphaticRings | 9 |