TPCN05423
Name | 3-O-[??-L-rhamnopyranosyl-(1 ?? 2)-??-D-glucopyranosyl]-3??,6??,16??,25-tetrahydroxy-20(R),24(R)-epoxycycloartane |
Molecular Formula | C42H68O14 |
Molecular Weight | 796.99 |
CAS Registry Number | 1427450-29-0 |
SMILES | CC1OC(OC2C(OC3CCC45CC46CCC4(C)C(C7(C)CCC(C(C)(C)O)O7)C(=O)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 | 0.001090% | Planta Med. 2012. 78, 720-729. | 10.1055/s-0031-1298337 |
Properties
HBA | 14 | HBD | 8 |
HeavyAtoms | 56 | AlogP | 1.32 |
TPSA | 225.06 | RotatableBonds | 7 |
FractionCSP3 | 0.98 | Rings | 8 |
AromaticRings | 0 | AliphaticRings | 8 |