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CHEBI:172085 - alpha-Carboxy-delta-nonalactone

ChEBI IDCHEBI:172085
ChEBI Namealpha-Carboxy-delta-nonalactone
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC10H16O4
Net Charge0
Average Mass200.234
Monoisotopic Mass200.10486
SMILESCCCCC1CCC(C(=O)O)C(=O)O1
InChIInChI=1S/C10H16O4/c1-2-3-4-7-5-6-8(9(11)12)10(13)14-7/h7-8H,2-6H2,1H3,(H,11,12)
InChIKeyAVHURGYCHVYRHG-UHFFFAOYSA-N
Species of MetaboliteComponentSourceComments
Homo sapiens (ncbitaxon:9606)
Pooled sample (NCIT:C45910) MetaboLights (MTBLS2128)
blood plasma (BTO:0000131) MetaboLights (MTBLS2128)
ChEBI Ontology
Outgoing Relation(s)
alpha-Carboxy-delta-nonalactone (CHEBI:172085) is a δ-lactone (CHEBI:18946)
IUPAC Name 
6-butyl-2-oxooxane-3-carboxylic acid
Manual XrefsDatabases
35013301ChemSpider
HMDB0030990HMDB