TPCN06107

Name Acantrifoic acid A
Molecular Formula C32H48O7
Molecular Weight 544.73
CAS Registry Number 654663-85-1
SMILES C=C(CO)C1CCC2(C(=O)O)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 0.000811% Chem Pharm Bull (Tokyo) . 2003 Dec;51(12):1432-5 10.1248/cpb.51.1432
Properties
HBA 7 HBD 3
HeavyAtoms 39 AlogP 5.70
TPSA 121.13 RotatableBonds 5
FractionCSP3 0.84 Rings 5
AromaticRings 0 AliphaticRings 5