TPCN01386

Name Kissoone C
Molecular Formula C17H24O3
Molecular Weight 276.38
CAS Registry Number 903559-03-5
SMILES CC(=O)OCC1=CCCC(=O)C=CC2C(CC1)C2(C)C
Classify Sesquiterpenoids
Content
Family Species Part Content (%) Reference DOI
Asteraceae Valeriana amurensis Roots 0.000585% Fitoterapia 96: 18-24.(2014) 10.1016/j.fitote.2014.03.025
Properties
HBA 3 HBD 0
HeavyAtoms 20 AlogP 3.45
TPSA 43.37 RotatableBonds 2
FractionCSP3 0.65 Rings 2
AromaticRings 0 AliphaticRings 2