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CHEBI:36407 - 5-hydroxy-N-formyl-L-kynurenine

ChEBI IDCHEBI:36407
ChEBI Name5-hydroxy-N-formyl-L-kynurenine
Stars
ASCII Name5-hydroxy-N-formyl-L-kynurenine
Secondary ChEBI IDCHEBI:20578
Last Modified28 July 2014
SubmitterKirill Degtyarenko
DownloadsMolfile
FormulaC11H12N2O5
Net Charge0
Average Mass252.226
Monoisotopic Mass252.07462
SMILES[H]C(=O)Nc1ccc(O)cc1C(=O)C[C@H](N)C(=O)O
InChIInChI=1S/C11H12N2O5/c12-8(11(17)18)4-10(16)7-3-6(15)1-2-9(7)13-5-14/h1-3,5,8,15H,4,12H2,(H,13,14)(H,17,18)/t8-/m0/s1
InChIKeyLSTOUSIIVKMJBU-QMMMGPOBSA-N
Roles Classification
Chemical Roles:
Bronsted base  A molecular entity capable of accepting a hydron from a donor (Brønsted acid).
Bronsted acid  A molecular entity capable of donating a hydron to an acceptor (Brønsted base).
Bronsted base  A molecular entity capable of accepting a hydron from a donor (Brønsted acid).
Bronsted acid  A molecular entity capable of donating a hydron to an acceptor (Brønsted base).
Biological Role:
human metabolite  Any mammalian metabolite produced during a metabolic reaction in humans (Homo sapiens).
ChEBI Ontology
Outgoing Relation(s)
5-hydroxy-N-formyl-L-kynurenine (CHEBI:36407) has functional parent N-formyl-L-kynurenine (CHEBI:30249)
5-hydroxy-N-formyl-L-kynurenine (CHEBI:36407) has functional parent 5-hydroxy-L-kynurenine (CHEBI:36408)
5-hydroxy-N-formyl-L-kynurenine (CHEBI:36407) is a 5-hydroxy-N-formylkynurenine (CHEBI:2065)
IUPAC Name 
(2S)-2-amino-4-(2-formamido-5-hydroxyphenyl)-4-oxobutanoic acid
Synonym  Source
5-Hydroxy-N-formyl-L-kynurenineKEGG COMPOUND
Manual XrefsDatabases
C05648KEGG COMPOUND