TPCN04863

Name Saponin 9
Molecular Formula C36H58O10
Molecular Weight 650.85
CAS Registry Number 1008775-60-7
SMILES CC1(C)CC2C3=CCC4C5(C)CCC(OC6OC(CO)C(O)C(O)C6O)C(C)(C=O)C5C(O)CC4(C)C3(C)CC(O)C2(C)CC1O
Classify Triterpenoids
Content
Family Species Part Content (%) Reference DOI
Asteraceae Silphium radula Aerial parts 0.019280% Phytochemistry 69, 961-972 (2008). 10.1016/j.phytochem.2007.10.017
Properties
HBA 10 HBD 7
HeavyAtoms 46 AlogP 2.08
TPSA 177.14 RotatableBonds 4
FractionCSP3 0.92 Rings 6
AromaticRings 0 AliphaticRings 6