TPCN02451

Name Jatrophenone
Molecular Formula C22H30O4
Molecular Weight 358.48
CAS Registry Number 623944-97-8
SMILES C=C(C)C1C=CC(C)C(=O)C2CC(C)C(OC(C)=O)C2=CC(C)C(=O)C1
Classify Diterpenoids
Content
Family Species Part Content (%) Reference DOI
Euphorbiaceae Jatropha gossypifolia Aerial parts 0.001200% Chem Pharm Bull (Tokyo) 51, 870-871 (2003). 10.1248/cpb.51.870
Properties
HBA 4 HBD 0
HeavyAtoms 26 AlogP 4.06
TPSA 60.44 RotatableBonds 2
FractionCSP3 0.59 Rings 2
AromaticRings 0 AliphaticRings 2