TPCN05153

Name Combreglucoside
Molecular Formula C36H58O12
Molecular Weight 682.85
CAS Registry Number 173485-48-8
SMILES CC1(C)CCC2(C(=O)OC3OC(CO)C(O)C(O)C3O)CCC3(C)C(=CCC4C5(C)CC(O)C(O)C(C)(CO)C5C(O)CC43C)C2C1O
Classify Triterpenoids
Content
Family Species Part Content (%) Reference DOI
Combretaceae Combretum quadrangulare Seeds 0.000222% Chem Pharm Bull (Tokyo) 48, 1114-1120 (2000) 10.1248/cpb.48.1114
Properties
HBA 12 HBD 9
HeavyAtoms 48 AlogP 0.38
TPSA 217.60 RotatableBonds 4
FractionCSP3 0.92 Rings 6
AromaticRings 0 AliphaticRings 6