TPCN06077

Name Acantrifoside C
Molecular Formula C50H78O21
Molecular Weight 1015.15
CAS Registry Number 654663-86-2
SMILES C=C(CO)C1CCC2(C(=O)OC3OC(COC4OC(CO)C(OC5OC(C)C(O)C(O)C5O)C(O)C4O)C(O)C(O)C3O)CCC3(C)C(CCC4C5(C)CCC(OC(C)=O)C(C)(C(=O)O)C5CCC43C)C12
Classify Triterpenoids
Content
Family Species Part Content (%) Reference DOI
Araliaceae Eleutherococcus trifoliatus Leaves 0.001216% Chem Pharm Bull (Tokyo) . 2003 Dec;51(12):1432-5 10.1248/cpb.51.1432
Properties
HBA 21 HBD 11
HeavyAtoms 71 AlogP -0.37
TPSA 338.35 RotatableBonds 12
FractionCSP3 0.90 Rings 8
AromaticRings 0 AliphaticRings 8