3-ketoheptanoate

General

Type : Fatty acid

Chemical_Nomenclature : 3-oxoheptanoic acid

Canonical SMILES : CCCCC(=O)CC(=O)O || CCCCC(=O)CC(=O)[O-]

InChI : InChI=1S\/C7H12O3\/c1-2-3-4-6(8)5-7(9)10\/h2-5H2,1H3,(H,9,10)

InChIKey : PRRBQHNMYJRHFW-UHFFFAOYSA-N || PRRBQHNMYJRHFW-UHFFFAOYSA-M

Other name(s) : 3-Oxoheptanoic acid  ||  3-oxo-heptanoic acid  ||  n-valeryl acetic acid  ||  Heptanoic acid, 3-oxo-  ||  SCHEMBL380858  ||  CHEBI:179402  ||  ETHYLPropionylacetate  ||  AKOS024257297  ||  3-oxoheptanoate


MW : 144.17

Formula : C7H12O3

CAS_number : 63563-21-3

PubChem : 113342,    19704454

UniChem : PRRBQHNMYJRHFW-UHFFFAOYSA-N,    PRRBQHNMYJRHFW-UHFFFAOYSA-M

Target

Families : 3-ketoheptanoate ligand of proteins in family
Hydroxynitrile_lyase

Protein :
solha-e0ycs2

References (1)

Title : Emergent decarboxylase activity and attenuation of alpha\/beta-hydrolase activity during the evolution of methylketone biosynthesis in tomato - Auldridge_2012_Plant.Cell_24_1596
Author(s) : Auldridge ME , Guo Y , Austin MB , Ramsey J , Fridman E , Pichersky E , Noel JP
Ref : Plant Cell , 24 :1596 , 2012
Abstract :
PubMedSearch : Auldridge_2012_Plant.Cell_24_1596
PubMedID: 22523203
Gene_locus related to this paper: solha-e0ycs2