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