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CHEBI:67010 - L-kynureninate

ChEBI IDCHEBI:67010
ChEBI NameL-kynureninate
Stars
ASCII NameL-kynureninate
DefinitionA L-α-amino acid anion obtained by the deprotonation of the carboxy group of L-kynurenine .
Last Modified17 June 2014
Submitternamrata
DownloadsMolfile
FormulaC10H11N2O3
Net Charge-1
Average Mass207.209
Monoisotopic Mass207.07752
SMILESNc1ccccc1C(=O)C[C@H](N)C(=O)[O-]
InChIInChI=1S/C10H12N2O3/c11-7-4-2-1-3-6(7)9(13)5-8(12)10(14)15/h1-4,8H,5,11-12H2,(H,14,15)/p-1/t8-/m0/s1
InChIKeyYGPSJZOEDVAXAB-QMMMGPOBSA-M
Roles Classification
Biological Role:
human metabolite  Any mammalian metabolite produced during a metabolic reaction in humans (Homo sapiens).
ChEBI Ontology
Outgoing Relation(s)
L-kynureninate (CHEBI:67010) has role human metabolite (CHEBI:77746)
L-kynureninate (CHEBI:67010) is a L-α-amino acid anion (CHEBI:59814)
L-kynureninate (CHEBI:67010) is a kynureninate (CHEBI:67008)
L-kynureninate (CHEBI:67010) is conjugate base of L-kynurenine (CHEBI:16946)
Incoming Relation(s)
L-kynurenine (CHEBI:16946) is conjugate acid of L-kynureninate (CHEBI:67010)
IUPAC Name 
(2S)-2-amino-4-(2-aminophenyl)-4-oxobutanoate
Synonym  Source
3-(2-aminobenzoyl)-L-alanine(1−)ChEBI