TPCN05234

Name Kudzusaponin SA2
Molecular Formula C47H76O19
Molecular Weight 945.11
CAS Registry Number 168288-05-9
SMILES CC1(C)CC2C3=CCC4C5(C)CCC(OC6OC(C(=O)O)C(O)C(O)C6OC6OC(CO)C(O)C(O)C6O)C(C)(CO)C5CCC4(C)C3(C)CCC2(C)C(OC2OCC(O)C(O)C2O)C1O
Classify Triterpenoids
Content
Family Species Part Content (%) Reference DOI
Fabaceae Pueraria lobata Roots 0.000011% Chem Pharm Bull (Tokyo) 43, 1176-1179 (1995). 10.1248/cpb.43.1176
Properties
HBA 19 HBD 12
HeavyAtoms 66 AlogP -0.71
TPSA 315.21 RotatableBonds 9
FractionCSP3 0.94 Rings 8
AromaticRings 0 AliphaticRings 8