TPCN04249

Name Pleurosaponin C
Molecular Formula C42H70O15
Molecular Weight 815.01
CAS Registry Number 1447451-84-4
SMILES CC1(C)CC2C3=CCC4C5(C)CCC(O)C(C)(CO)C5CCC4(C)C3(C)CC(O)C2(CO)CC1OC1OC(CO)C(O)C(O)C1OC1OC(CO)C(O)C(O)C1O
Classify Triterpenoids
Content
Family Species Part Content (%) Reference DOI
Apiaceae Pleurospermum kamtschaticum Aerial parts 0.004000% Chem Pharm Bull (Tokyo) 60(8): 1011-1018. 10.1248/cpb.c12-00274
Properties
HBA 15 HBD 11
HeavyAtoms 57 AlogP -0.30
TPSA 259.45 RotatableBonds 8
FractionCSP3 0.95 Rings 7
AromaticRings 0 AliphaticRings 7