HOPDA-5,8-diF

General

Type : Ketone

Chemical_Nomenclature : (3E,5R)-5-fluoro-6-(2-fluorophenyl)-2,6-dioxohex-3-enoic acid

Canonical SMILES : OC(=O)C(=O)C=CC(F)C(=O)c1ccccc1F

InChI : InChI=1S\/C12H8F2O4\/c13-8-4-2-1-3-7(8)11(16)9(14)5-6-10(15)12(17)18\/h1-6,9H,(H,17,18)\/b6-5+\/t9-\/m1\/s1

InChIKey : YTBJKOAMJGQNPQ-VUHVRTRXSA-N

Other name(s) : (3E,5R)-5-Fluoro-6-(2-fluorophenyl)-2,6-dioxo-3-hexenoic acid  ||  22J


MW : 254.18

Formula : C12H8F2O4

CAS_number :

PubChem : 71737845

UniChem : YTBJKOAMJGQNPQ-VUHVRTRXSA-N

Target

Structures : 4LXI

Families : Carbon-carbon_bond_hydrolase

References (2)

Title : The Lid Domain of the MCP Hydrolase DxnB2 Contributes to the Reactivity toward Recalcitrant PCB Metabolites - Ruzzini_2013_Biochemistry_52_5685
Author(s) : Ruzzini AC , Bhowmik S , Yam KC , Ghosh S , Bolin JT , Eltis LD
Ref : Biochemistry , 52 :5685 , 2013
Abstract :
PubMedSearch : Ruzzini_2013_Biochemistry_52_5685
PubMedID: 23879719
Gene_locus related to this paper: sphww-a5j2a5

Title : A substrate-assisted mechanism of nucleophile activation in a ser-his-asp containing C-C bond hydrolase - Ruzzini_2013_Biochemistry_52_7428
Author(s) : Ruzzini AC , Bhowmik S , Ghosh S , Yam KC , Bolin JT , Eltis LD
Ref : Biochemistry , 52 :7428 , 2013
Abstract :
PubMedSearch : Ruzzini_2013_Biochemistry_52_7428
PubMedID: 24067021
Gene_locus related to this paper: sphww-a5j2a5