TPCN05225

Name Kudzusaponin A5
Molecular Formula C48H78O20
Molecular Weight 975.13
CAS Registry Number 179910-81-7
SMILES CC1OC(OC2C(OC3C(OC4CCC5(C)C(CCC6(C)C5CC=C5C7CC(C)(CO)C(O)C(O)C7(C)CCC56C)C4(C)CO)OC(C(=O)O)C(O)C3O)OC(CO)C(O)C2O)C(O)C(O)C1O
Classify Triterpenoids
Content
Family Species Part Content (%) Reference DOI
Fabaceae Pueraria lobata Roots 0.000033% Chem Pharm Bull (Tokyo) 45, 362-366 (1997) 10.1248/cpb.45.362
Properties
HBA 20 HBD 13
HeavyAtoms 68 AlogP -1.35
TPSA 335.44 RotatableBonds 10
FractionCSP3 0.94 Rings 8
AromaticRings 0 AliphaticRings 8