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CHEBI:87295 - diethyl 2-hydroxypentanedioate

ChEBI IDCHEBI:87295
ChEBI Namediethyl 2-hydroxypentanedioate
Stars
DefinitionA diester obtained by the formal condensation of both the carboxy groups of 2-hydroxyglutaric acid with two molecules of ethanol respectively.
Last Modified6 September 2021
Submitternamrata
DownloadsMolfile
FormulaC9H16O5
Net Charge0
Average Mass204.222
Monoisotopic Mass204.09977
SMILESCCOC(=O)CCC(O)C(=O)OCC
InChIInChI=1S/C9H16O5/c1-3-13-8(11)6-5-7(10)9(12)14-4-2/h7,10H,3-6H2,1-2H3
InChIKeyDYLHSDCNOUDICA-UHFFFAOYSA-N
Roles Classification
Biological Role:
metabolite  Any intermediate or product resulting from metabolism. The term 'metabolite' subsumes the classes commonly known as primary and secondary metabolites.
ChEBI Ontology
Outgoing Relation(s)
diethyl 2-hydroxypentanedioate (CHEBI:87295) has functional parent 2-hydroxyglutaric acid (CHEBI:17084)
diethyl 2-hydroxypentanedioate (CHEBI:87295) has role metabolite (CHEBI:25212)
diethyl 2-hydroxypentanedioate (CHEBI:87295) is a dicarboxylic acids and O-substituted derivatives (CHEBI:131927)
diethyl 2-hydroxypentanedioate (CHEBI:87295) is a diester (CHEBI:51307)
IUPAC Name 
diethyl 2-hydroxypentanedioate
Synonyms  Source
diethyl 2-hydroxyglutarateChEBI
2-hydroxyglutaric acid diethyl esterChEBI
Registry NumbersSources
Reaxys:1726673Reaxys