TPCN05511

Name Aradecoside D
Molecular Formula C59H96O27
Molecular Weight 1237.39
CAS Registry Number 866954-79-2
SMILES CC1(C)CCC2(C(=O)OC3OC(COC4OC(CO)C(O)C(O)C4O)C(O)C(O)C3O)CCC3(C)C(=CCC4C5(C)CCC(OC6OCC(O)C(OC7OC(CO)C(O)C(O)C7O)C6OC6OC(CO)C(O)C(O)C6O)C(C)(C)C5CCC43C)C2C1
Classify Triterpenoids
Content
Family Species Part Content (%) Reference DOI
Lardizabalaceae Akebia trifoliata Stems 0.000333% Phytochemistry. 2006. 67, 2697-2705. 10.1016/j.phytochem.2006.09.003.
Properties
HBA 27 HBD 16
HeavyAtoms 86 AlogP -3.57
TPSA 433.05 RotatableBonds 14
FractionCSP3 0.95 Rings 10
AromaticRings 0 AliphaticRings 10