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CHEBI:191163 - Rac-alpha-methyl kynurenine

ChEBI IDCHEBI:191163
ChEBI NameRac-alpha-methyl kynurenine
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC11H14N2O3
Net Charge0
Average Mass222.244
Monoisotopic Mass222.10044
SMILESCC(N)(CC(=O)c1ccccc1N)C(=O)O
InChIInChI=1S/C11H14N2O3/c1-11(13,10(15)16)6-9(14)7-4-2-3-5-8(7)12/h2-5H,6,12-13H2,1H3,(H,15,16)
InChIKeyPQEUTGZYJPUCNX-UHFFFAOYSA-N
Species of MetaboliteComponentSourceComments
Rattus norvegicus (ncbitaxon:10116) INS-1 cell (BTO:0002135) MetaboLights (MTBLS3963)
ChEBI Ontology
Outgoing Relation(s)
Rac-alpha-methyl kynurenine (CHEBI:191163) is a aromatic ketone (CHEBI:76224)
IUPAC Name 
2-amino-4-(2-aminophenyl)-2-methyl-4-oxobutanoic acid
Manual XrefsDatabases
48062761ChemSpider