TPCN01211

Name Ferulaeone B;Fukanedone B
Molecular Formula C24H32O5
Molecular Weight 400.52
CAS Registry Number 850621-98-6
SMILES CC(C)=CCCC(C)=CCCC1(C)OC(=O)C(C(=O)c2ccc(O)cc2O)C1C
Classify Sesquiterpenoids
Content
Family Species Part Content (%) Reference DOI
Asteraceae Ferula ferulaeoides Roots 0.001290% Phytochemistry 86: 151-158.(2013) 10.1016/j.phytochem.2012.10.013
Asteraceae Ferula fukanensis Roots 0.000349% J Nat Prod 68(3): 365-368.(2005) 10.1021/np040215c
Properties
HBA 5 HBD 2
HeavyAtoms 29 AlogP 5.32
TPSA 83.83 RotatableBonds 8
FractionCSP3 0.50 Rings 2
AromaticRings 1 AliphaticRings 1