TPCN02455

Name Jatrophalactam
Molecular Formula C20H29NO3
Molecular Weight 331.46
CAS Registry Number 1193682-55-1
SMILES CC1=C2C(=O)NC1C=CC(C)(O)CCC1C(CC(C)C2=O)C1(C)C
Classify Diterpenoids
Content
Family Species Part Content (%) Reference DOI
Euphorbiaceae Jatropha curcas Roots 0.001167% Org Lett 11, 5522-5524 (2009). 10.1021/ol902349f
Properties
HBA 4 HBD 2
HeavyAtoms 24 AlogP 2.77
TPSA 66.40 RotatableBonds 0
FractionCSP3 0.70 Rings 3
AromaticRings 0 AliphaticRings 3