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CHEBI:172431 - Acetyl-Glu

ChEBI IDCHEBI:172431
ChEBI NameAcetyl-Glu
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC7H11NO5
Net Charge0
Average Mass189.167
Monoisotopic Mass189.06372
SMILESCC(=O)NC(CCC(=O)O)C(=O)O
InChIInChI=1S/C7H11NO5/c1-4(9)8-5(7(12)13)2-3-6(10)11/h5H,2-3H2,1H3,(H,8,9)(H,10,11)(H,12,13)
InChIKeyRFMMMVDNIPUKGG-UHFFFAOYSA-N
Species of MetaboliteComponentSourceComments
Homo sapiens (ncbitaxon:9606) blood plasma (BTO:0000131) MetaboLights (MTBLS2633)
ChEBI Ontology
Outgoing Relation(s)
Acetyl-Glu (CHEBI:172431) is a glutamic acid derivative (CHEBI:24315)
IUPAC Name 
2-acetamidopentanedioic acid
Manual XrefsDatabases
180ChemSpider
C00624KEGG COMPOUND
ACETYL-GLUMetaCyc
HMDB0001138HMDB
Registry NumbersSources
CAS:5817-08-3ChemIDplus