TPCN05131

Name Echinosophorosides B
Molecular Formula C52H84O22
Molecular Weight 1061.22
CAS Registry Number 775312-39-5
SMILES CC1OC(OC2C(OC3C(OC4CCC5(C)C(CCC6(C)C5CC=C5C7CC(C)(CO)C(O)C(OC8OCC(O)C(O)C8O)C7(C)CCC56C)C4(C)C)OC(C(=O)O)C(O)C3O)OCC(O)C2O)C(O)C(O)C1O
Classify Triterpenoids
Content
Family Species Part Content (%) Reference DOI
Fabaceae Sophora koreensis Roots 0.000308% Chem Pharm Bull (Tokyo) 52, 870-873 (2004) 10.1248/cpb.52.870
Properties
HBA 22 HBD 13
HeavyAtoms 74 AlogP -1.22
TPSA 353.90 RotatableBonds 10
FractionCSP3 0.94 Rings 9
AromaticRings 0 AliphaticRings 9