TPCN05285

Name Bacopasaponin C
Molecular Formula C46H74O17
Molecular Weight 899.08
CAS Registry Number 178064-13-6
SMILES CC(C)=CC1COC23CC4(CO2)C(CCC2C5(C)CCC(OC6OCC(O)C(OC7OC(CO)C(O)C(O)C7O)C6OC6OC(CO)C(O)C6O)C(C)(C)C5CCC24C)C3C1(C)O
Classify Triterpenoids
Content
Family Species Part Content (%) Reference DOI
Scrophulariaceae Bacopa monniera Leaves 0.010000% Phytochemistry. 1996. 42, 815-820. 10.1016/0031-9422(95)00936-1.
Properties
HBA 17 HBD 9
HeavyAtoms 63 AlogP 0.46
TPSA 255.91 RotatableBonds 9
FractionCSP3 0.96 Rings 9
AromaticRings 0 AliphaticRings 9