TPCN01252

Name Eupatolide
Molecular Formula C15H20O3
Molecular Weight 248.32
CAS Registry Number 6750-25-0
SMILES C=C1C(=O)OC2C=C(C)CCC=C(C)CC(O)C12
Classify Sesquiterpenoids
Content
Family Species Part Content (%) Reference DOI
Malpighiaceae Inula britannica Aerial parts 0.001111% Planta Med 72(1): 40-45.(2006) 10.1055/s-2005-873189
Properties
HBA 3 HBD 1
HeavyAtoms 18 AlogP 2.52
TPSA 46.53 RotatableBonds 0
FractionCSP3 0.53 Rings 2
AromaticRings 0 AliphaticRings 2