TPCN05496

Name Mutongsaponin E
Molecular Formula C57H90O25
Molecular Weight 1175.32
CAS Registry Number 920518-02-1
SMILES C=C1CCC2(C(=O)OC3OC(COC4OC(CO)C(OC5OC(C)C(O)C(O)C5O)C(O)C4O)C(O)C(O)C3O)CCC3(C)C(=CCC4C5(C)CCC(OC6OCC(O)C(O)C6OC6OCC(O)C(O)C6O)C(C)(C)C5CCC43C)C2C1
Classify Triterpenoids
Content
Family Species Part Content (%) Reference DOI
Lardizabalaceae Akebia trifoliata Stems 0.000433% Phytochemistry. 2006. 67, 2697-2705. 10.1016/j.phytochem.2006.09.003.
Properties
HBA 25 HBD 14
HeavyAtoms 82 AlogP -2.38
TPSA 392.59 RotatableBonds 12
FractionCSP3 0.91 Rings 10
AromaticRings 0 AliphaticRings 10