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CHEBI:232955 - (2S)-2-acetamido-4-(2-aminophenyl)-4-oxobutanoic acid

ChEBI IDCHEBI:232955
ChEBI Name(2S)-2-acetamido-4-(2-aminophenyl)-4-oxobutanoic acid
Stars
Submittermwilliams
DownloadsMolfile
FormulaC12H14N2O4
Net Charge0
Average Mass250.254
Monoisotopic Mass250.09536
SMILESCC(=O)N[C@@H](CC(=O)c1ccccc1N)C(=O)O
InChIInChI=1S/C12H14N2O4/c1-7(15)14-10(12(17)18)6-11(16)8-4-2-3-5-9(8)13/h2-5,10H,6,13H2,1H3,(H,14,15)(H,17,18)/t10-/m0/s1
InChIKeyPPIMFXHQDQRWGJ-JTQLQIEISA-N
ChEBI Ontology
Outgoing Relation(s)
(2S)-2-acetamido-4-(2-aminophenyl)-4-oxobutanoic acid (CHEBI:232955) is a aromatic ketone (CHEBI:76224)
Synonym  Source
N-acetylkynurenineSUBMITTER
Manual XrefsDatabases
HMDB0240342HMDB