Acetylacetone

General

Type : Analogue of substrate

Chemical_Nomenclature : pentane-2,4-dione

Canonical SMILES : CC(=O)CC(=O)C

InChI : InChI=1S\/C5H8O2\/c1-4(6)3-5(2)7\/h3H2,1-2H3

InChIKey : YRKCREAYFQTBPV-UHFFFAOYSA-N

Other name(s) : 2,4-Pentanedione  ||  Pentane-2,4-dione  ||  2,4-Pentadione  ||  Diacetylmethane


MW : 100.11

Formula : C5H8O2

CAS_number : 123-54-6

PubChem : 31261

UniChem : YRKCREAYFQTBPV-UHFFFAOYSA-N

Target

Families : Acetylacetone ligand of proteins in family
AlphaBeta_hydrolase

Structure :
3WL7

Protein :
psesp-OPH

References (1)

Title : Structural insights into enzymatic degradation of oxidized polyvinyl alcohol - Yang_2014_Chembiochem_15_1882
Author(s) : Yang Y , Ko TP , Liu L , Li J , Huang CH , Chan HC , Ren F , Jia D , Wang AH , Guo RT , Chen J , Du G
Ref : Chembiochem , 15 :1882 , 2014
Abstract :
PubMedSearch : Yang_2014_Chembiochem_15_1882
PubMedID: 25044912
Gene_locus related to this paper: psesp-OPH , sphs1-OPH