TPCN06046

Name Akemisaponin F
Molecular Formula C52H80O23
Molecular Weight 1073.19
CAS Registry Number 1450732-71-4
SMILES CC1=CCC2(C(=O)OC3OC(COC4OC(CO)C(OC5OC(C)C(O)C(OC6OCC(O)C(O)C6O)C5O)C(O)C4O)C(O)C(O)C3O)CCC3(C)C(=CCC4C5(C)CC(O)C(O)C(C)(C=O)C5CCC43C)C2C1
Classify Triterpenoids
Content
Family Species Part Content (%) Reference DOI
Lardizabalaceae Akebia trifoliata Peels 0.002000% Chem Pharm Bull (Tokyo) . 2012;60(10):1264-74 10.1248/cpb.c12-00448
Properties
HBA 23 HBD 13
HeavyAtoms 75 AlogP -2.69
TPSA 370.97 RotatableBonds 11
FractionCSP3 0.88 Rings 9
AromaticRings 0 AliphaticRings 9