TPCN01118

Name 2,3-dihydroaromomaticin
Molecular Formula C15H20O3
Molecular Weight 248.32
CAS Registry Number 110115-60-1
SMILES C=C1C(=O)OC2CC(C)C3CCC(=O)C3(C)CC12
Classify Sesquiterpenoids
Content
Family Species Part Content (%) Reference DOI
Asteraceae Carpesium abrotanoides Aerial parts 0.002167% Planta Med 68(8): 745-747.(2002) 10.1055/s-2002-33789
Properties
HBA 3 HBD 0
HeavyAtoms 18 AlogP 2.50
TPSA 43.37 RotatableBonds 0
FractionCSP3 0.73 Rings 3
AromaticRings 0 AliphaticRings 3