TPCN00840

Name 3,6-epidioxy-1,10-bisaboladiene (EDBD)
Molecular Formula C15H24O2
Molecular Weight 236.36
CAS Registry Number 849467-85-2
SMILES CC(C)=CCCC(C)C12C=CC(C)(CC1)OO2
Classify Sesquiterpenoids
Content
Family Species Part Content (%) Reference DOI
Asteraceae Japonicalia delphiniifolia Whole plants 0.044154% Biosci Biotechnol Biochem 72(9): 2463-2466.(2008) 10.1271/bbb.80266
Properties
HBA 2 HBD 0
HeavyAtoms 17 AlogP 4.18
TPSA 18.46 RotatableBonds 4
FractionCSP3 0.73 Rings 3
AromaticRings 0 AliphaticRings 3