TPCN05398

Name Ladyginoside A
Molecular Formula C42H66O14
Molecular Weight 794.98
CAS Registry Number 38424-95-2
SMILES CC1(C)CCC2(C(=O)O)CCC3(C)C(=CCC4C5(C)CCC(OC6OC(C(=O)O)C(OC7OC(CO)C(O)C(O)C7O)C(O)C6O)C(C)(C)C5CCC43C)C2C1
Classify Triterpenoids
Content
Family Species Part Content (%) Reference DOI
Araliaceae Polyscias fruticosa Leaves 0.001513% Nat Prod Res. 2019. 1-6. 10.1080/14786419.2018.1557657.
Properties
HBA 14 HBD 8
HeavyAtoms 56 AlogP 2.97
TPSA 232.90 RotatableBonds 7
FractionCSP3 0.90 Rings 7
AromaticRings 0 AliphaticRings 7