U.S. Department of Health & Human Services Divider Arrow National Institutes of Health Divider Arrow NCATS

Details

Stereochemistry RACEMIC
Molecular Formula C17H14F2O3
Molecular Weight 304.2881
Optical Activity ( + / - )
Defined Stereocenters 0 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of FLOBUFEN

SMILES

CC(CC(=O)C1=CC=C(C=C1)C2=CC=C(F)C=C2F)C(O)=O

InChI

InChIKey=FIKVYIRIUOFLLR-UHFFFAOYSA-N
InChI=1S/C17H14F2O3/c1-10(17(21)22)8-16(20)12-4-2-11(3-5-12)14-7-6-13(18)9-15(14)19/h2-7,9-10H,8H2,1H3,(H,21,22)

HIDE SMILES / InChI

Molecular Formula C17H14F2O3
Molecular Weight 304.2881
Charge 0
Count
Stereochemistry RACEMIC
Additional Stereochemistry No
Defined Stereocenters 0 / 1
E/Z Centers 0
Optical Activity ( + / - )

Approval Year

PubMed

PubMed

TitleDatePubMed
Liquid chromatographic-electrospray mass spectrometric determination (LC-ESI-MS) of phase II metabolites of flobufen in rat liver microsomes-Chiral discrimination.
2008-04-15
Vancomycin as chiral selector for enantioselective separation of selected profen nonsteroidal anti-inflammatory drugs in capillary liquid chromatography.
2006-08
Synthesis and enhancing effect of transkarbam 12 on the transdermal delivery of theophylline, clotrimazole, flobufen, and griseofulvin.
2006-05
Comparison of vancomycin-based stationary phases with different chiral selector coverage for enantioselective separation of selected drugs in high-performance liquid chromatography.
2005-09-23
Pharmacological profile of 4-(2',4'-difluorobiphenyl-4-yl)-2-methylbutyric acid (deoxoflobufen).
2005
Stereospecificity of flobufen metabolism in guinea pigs in vitro and in vivo: phase I of biotransformation.
2004-01
Stereoselective pharmacokinetics and metabolism of flobufen in guinea pigs.
2003-10
The stereospecificity of flobufen metabolism in isolated guinea pig hepatocytes.
2003-06-05
Chiral aspects of metabolism of antiinflammatory drug flobufen in human hepatocytes.
2003-05-15
Reduction of flobufen in pig hepatocytes: effect of pig breed (domestic, wild) and castration.
2003-03
Enantioseparation of flobufen with cyclodextrins studied by capillary electrophoresis and NMR.
2001-06
Biotransformation of flobufen enantiomers in ruminant hepatocytes and subcellular fractions.
2001
Stereospecificity and stereoselectivity of flobufen metabolic profile in male rats in vitro and in vivo: phase I of biotransformation.
2001
Substance Class Chemical
Created
by admin
on Mon Mar 31 21:58:16 GMT 2025
Edited
by admin
on Mon Mar 31 21:58:16 GMT 2025
Record UNII
0LNC8EZT75
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
FLOBUFEN
Common Name English
VUFB 16066
Preferred Name English
FLOBUFEN, (±)-
Common Name English
VUFB-16066
Code English
(1,1'-BIPHENYL)-4-BUTANOIC ACID, 2',4'-DIFLUORO-.ALPHA.-METHYL-.GAMMA.-OXO-
Systematic Name English
Code System Code Type Description
CAS
112344-52-2
Created by admin on Mon Mar 31 21:58:16 GMT 2025 , Edited by admin on Mon Mar 31 21:58:16 GMT 2025
PRIMARY
FDA UNII
0LNC8EZT75
Created by admin on Mon Mar 31 21:58:16 GMT 2025 , Edited by admin on Mon Mar 31 21:58:16 GMT 2025
PRIMARY
PUBCHEM
159476
Created by admin on Mon Mar 31 21:58:16 GMT 2025 , Edited by admin on Mon Mar 31 21:58:16 GMT 2025
PRIMARY
EPA CompTox
DTXSID70874896
Created by admin on Mon Mar 31 21:58:16 GMT 2025 , Edited by admin on Mon Mar 31 21:58:16 GMT 2025
PRIMARY
CAS
104941-35-7
Created by admin on Mon Mar 31 21:58:16 GMT 2025 , Edited by admin on Mon Mar 31 21:58:16 GMT 2025
SUPERSEDED
Related Record Type Details
ACTIVE MOIETY