TPCN00897

Name Achillin
Molecular Formula C15H18O3
Molecular Weight 246.31
CAS Registry Number 5956-04-7
SMILES CC1=CC(=O)C2=C(C)CCC3C(C)C(=O)OC3C12
Classify Sesquiterpenoids
Content
Family Species Part Content (%) Reference DOI
Asteraceae Artemisia assoana Aerial parts 0.013333% Planta Med 54(5): 460-461.(1988) 10.1055/s-2006-962501
Properties
HBA 3 HBD 0
HeavyAtoms 18 AlogP 2.42
TPSA 43.37 RotatableBonds 0
FractionCSP3 0.60 Rings 3
AromaticRings 0 AliphaticRings 3