TPCN05294

Name Mutongsaponin C
Molecular Formula C53H86O23
Molecular Weight 1091.25
CAS Registry Number 920518-00-9
SMILES CC1CCC2(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)(CO)C5CCC43C)C2C1C
Classify Triterpenoids
Content
Family Species Part Content (%) Reference DOI
Lardizabalaceae Akebia trifoliata Stems 0.007333% Phytochemistry. 2006. 67, 2697-2705. 10.1016/j.phytochem.2006.09.003.
Properties
HBA 23 HBD 14
HeavyAtoms 76 AlogP -2.57
TPSA 374.13 RotatableBonds 11
FractionCSP3 0.94 Rings 9
AromaticRings 0 AliphaticRings 9