TPCN01757

Name Fukanefuromarin I
Molecular Formula C24H30O5
Molecular Weight 398.50
CAS Registry Number 1609002-85-8
SMILES CC(=CCCC(C)=CCCC1(C)Oc2c(c(=O)oc3cc(O)ccc23)C1C)CO
Classify Sesquiterpenoids
Content
Family Species Part Content (%) Reference DOI
Asteraceae Ferula fukanensis Roots 0.000141% Chem Pharm Bull (Tokyo) 61(6): 618-623.(2013) 10.1248/cpb.c12-01028
Properties
HBA 5 HBD 2
HeavyAtoms 29 AlogP 5.20
TPSA 79.90 RotatableBonds 7
FractionCSP3 0.46 Rings 3
AromaticRings 2 AliphaticRings 1