TPCN04285

Name Quadranoside ??;Quadranoside VIII
Molecular Formula C36H56O10
Molecular Weight 648.83
CAS Registry Number 297141-58-3
SMILES C=C1C(C)CCC2(C(=O)OC3OC(CO)C(O)C(O)C3O)CCC3(C)C(=CCC4C5(C)CC(O)C(O)C(C)(CO)C5CCC43C)C12
Classify Triterpenoids
Content
Family Species Part Content (%) Reference DOI
Rosaceae Rubus ellipticus Roots 0.002333% J Nat Prod 72(10): 1755-1760. 10.1021/np900237a
Combretaceae Combretum quadrangulare Seeds 0.000133% Chem Pharm Bull (Tokyo) 48, 1114-1120 (2000) 10.1248/cpb.48.1114
Properties
HBA 10 HBD 7
HeavyAtoms 46 AlogP 2.21
TPSA 177.14 RotatableBonds 4
FractionCSP3 0.86 Rings 6
AromaticRings 0 AliphaticRings 6