HOPDA-3,10-DiF

General

Type : Ketone

Chemical_Nomenclature : (2Z,4E)-3-fluoro-6-(4-fluorophenyl)-2-hydroxy-6-oxohexa-2,4-dienoic acid

Canonical SMILES : C1=CC(=CC=C1C(=O)C=CC(=C(C(=O)O)O)F)F

InChI : InChI=1S\/C12H8F2O4\/c13-8-3-1-7(2-4-8)10(15)6-5-9(14)11(16)12(17)18\/h1-6,16H,(H,17,18)\/b6-5+,11-9-

InChIKey : CPZFGNOKCMJZFO-BTHQEHEQSA-N

Other name(s) : 3-Fluoro-6-(4-Fluorophenyl)-2-Hydroxy-6-Oxohexa-2,4-Dienoic Acid  ||  DB07510  ||  (2Z,4E)-3-fluoro-6-(4-fluorophenyl)-2-hydroxy-6-oxohexa-2,4-dienoic acid  ||  C0E


MW : 254.18

Formula : C12H8F2O4

CAS_number :

PubChem : 23636976

UniChem : CPZFGNOKCMJZFO-BTHQEHEQSA-N

Target

Structures : 2RHW

Families : Carbon-carbon_bond_hydrolase

References (1)

Title : The molecular basis for inhibition of BphD, a C-C bond hydrolase involved in polychlorinated biphenyls degradation: large 3-substituents prevent tautomerization - Bhowmik_2007_J.Biol.Chem_282_36377
Author(s) : Bhowmik S , Horsman GP , Bolin JT , Eltis LD
Ref : Journal of Biological Chemistry , 282 :36377 , 2007
Abstract :
PubMedSearch : Bhowmik_2007_J.Biol.Chem_282_36377
PubMedID: 17932031
Gene_locus related to this paper: burxl-bphD