TPCN05140

Name Saponin 4
Molecular Formula C36H58O10
Molecular Weight 650.85
CAS Registry Number 1449246-95-0
SMILES CC1(CO)CCC2(CO)CCC3(C(=O)O)C(=CCC4C5(C)CCC(OC6OC(CO)C(O)C(O)C6O)C(C)(C)C5CCC43C)C2C1
Classify Triterpenoids
Content
Family Species Part Content (%) Reference DOI
Fabaceae Genista ulicina Aerial parts 0.000270% Phytochemistry 93, 176-181 (2013) 10.1016/j.phytochem.2013.03.020
Properties
HBA 10 HBD 7
HeavyAtoms 46 AlogP 3.00
TPSA 177.14 RotatableBonds 6
FractionCSP3 0.92 Rings 6
AromaticRings 0 AliphaticRings 6