TPCN01285

Name Asperpenoid
Molecular Formula C17H30O3
Molecular Weight 282.42
CAS Registry Number 1246952-50-0
SMILES CCOC1OC(CCC(C)=O)C2(C)CCC(C(C)C)C12
Classify Sesquiterpenoids
Content
Family Species Part Content (%) Reference DOI
Asteraceae Homalomena occulta Subterraneous stems 0.000950% Chem Biodivers 7(4): 984-992.(2010) 10.1016/j.bioorg.2019.103197
Properties
HBA 3 HBD 0
HeavyAtoms 20 AlogP 3.81
TPSA 35.53 RotatableBonds 6
FractionCSP3 0.94 Rings 2
AromaticRings 0 AliphaticRings 2