TPCN05303

Name ??-amyrin-3O-??-(5-hydroxy) ferulic acid
Molecular Formula C40H58O5
Molecular Weight 618.90
CAS Registry Number 1349109-79-0
SMILES COc1cc(C=CC(=O)OC2CCC3(C)C(CCC4(C)C3CC=C3C5C(C)C(C)CCC5(C)CCC34C)C2(C)C)cc(O)c1O
Classify Triterpenoids
Content
Family Species Part Content (%) Reference DOI
Ebenaceae Euclea undulata Barks 0.006642% J Ethnopharmacol. 2011. 133, 1091-1095. 10.1016/j.jep.2010.11.038
Properties
HBA 5 HBD 2
HeavyAtoms 45 AlogP 9.71
TPSA 75.99 RotatableBonds 4
FractionCSP3 0.73 Rings 6
AromaticRings 1 AliphaticRings 5