TPCN01910

Name Eudesmane K
Molecular Formula C15H22O
Molecular Weight 218.34
CAS Registry Number 86917-79-5
SMILES C=C(C)C1CCC2(C)CC(=O)C=C(C)C2C1
Classify Sesquiterpenoids
Content
Family Species Part Content (%) Reference DOI
Asteraceae Echinops grijsii Roots 0.000054% J Org Chem 84(17): 10757-10763.(2019) 10.1021/acs.joc.9b01212
Properties
HBA 1 HBD 0
HeavyAtoms 16 AlogP 3.90
TPSA 17.07 RotatableBonds 1
FractionCSP3 0.67 Rings 2
AromaticRings 0 AliphaticRings 2