TPCN01563

Name Anthecularin
Molecular Formula C15H18O3
Molecular Weight 246.31
CAS Registry Number 956723-21-0
SMILES CC1=CC23C=C(C)CC(O2)C2COC(=O)C23CC1
Classify Sesquiterpenoids
Content
Family Species Part Content (%) Reference DOI
Asteraceae Anthemis auriculata Aerial parts 0.000313% J Org Chem 72(21): 8103-8106.(2007) 10.1021/jo701751w
Properties
HBA 3 HBD 0
HeavyAtoms 18 AlogP 2.37
TPSA 35.53 RotatableBonds 0
FractionCSP3 0.67 Rings 4
AromaticRings 0 AliphaticRings 4