TPCN02131

Name 2,3-dihydroaromaticin
Molecular Formula C15H20O3
Molecular Weight 248.32
CAS Registry Number 72173-44-5
SMILES C=C1C(=O)OC2CC(C)C3CCC(=O)C3(C)CC12
Classify Sesquiterpenoids
Content
Family Species Part Content (%) Reference DOI
Asteraceae Carpesium abrotanoides Whole plants 0.000066% Natural Product Research, (2021). 10.1080/14786419.2021.1955881
Properties
HBA 3 HBD 0
HeavyAtoms 18 AlogP 2.50
TPSA 43.37 RotatableBonds 0
FractionCSP3 0.73 Rings 3
AromaticRings 0 AliphaticRings 3