CHEBI:17380 - 3-hydroxy-L-kynurenine

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
ChEBI Name 3-hydroxy-L-kynurenine
ChEBI ID CHEBI:17380
ChEBI ASCII Name 3-hydroxy-L-kynurenine
Stars This entity has been manually annotated by the ChEBI Team.
Secondary ChEBI IDs CHEBI:11823, CHEBI:1530, CHEBI:20055
Supplier Information
Download Molfile XML SDF
Formula C10H12N2O4
Net Charge 0
Average Mass 224.21336
Monoisotopic Mass 224.080
InChI InChI=1S/C10H12N2O4/c11-6(10(15)16)4-8(14)5-2-1-3-7(13)9(5)12/h1-3,6,13H,4,11-12H2,(H,15,16)/t6-/m0/s1
InChIKey VCKPUUFAIGNJHC-LURJTMIESA-N
SMILES N[C@@H](CC(=O)c1cccc(O)c1N)C(O)=O
Metabolite of Species Details
Mus musculus (NCBI:10090) Source: BioModels - MODEL1507180067 See: PubMed
Saccharomyces cerevisiae (NCBI:4932) See: PubMed
Saccharomyces cerevisiae (NCBI:4932) Source: yeast.sf.net See: PubMed
Homo sapiens (NCBI:9606) See: DOI
Roles Classification
Chemical Role(s): Bronsted acid
A molecular entity capable of donating a hydron to an acceptor (Bronsted base).
(via oxoacid )
Biological Role(s): mouse metabolite
Any mammalian metabolite produced during a metabolic reaction in a mouse (Mus musculus).
Saccharomyces cerevisiae metabolite
Any fungal metabolite produced during a metabolic reaction in Baker's yeast (Saccharomyces cerevisiae ).
human metabolite
Any mammalian metabolite produced during a metabolic reaction in humans (Homo sapiens).
(via 3-hydroxykynurenine )
View more via ChEBI Ontology
ChEBI Ontology
Outgoing 3-hydroxy-L-kynurenine (CHEBI:17380) has role Saccharomyces cerevisiae metabolite (CHEBI:75772)
3-hydroxy-L-kynurenine (CHEBI:17380) has role mouse metabolite (CHEBI:75771)
3-hydroxy-L-kynurenine (CHEBI:17380) is a 3-hydroxykynurenine (CHEBI:1547)
3-hydroxy-L-kynurenine (CHEBI:17380) is tautomer of 3-hydroxy-L-kynurenine zwitterion (CHEBI:58125)
Incoming 3-hydroxy-L-kynurenine zwitterion (CHEBI:58125) is tautomer of 3-hydroxy-L-kynurenine (CHEBI:17380)
IUPAC Name
3-(2-amino-3-hydroxybenzoyl)-L-alanine
Synonyms Sources
(2S)-2-amino-4-(2-amino-3-hydroxyphenyl)-4-oxobutanoic acid IUPAC
3-(3-hydroxyanthraniloyl)-L-alanine ChemIDplus
3-Hydroxy-L-kynurenine KEGG COMPOUND
L-3-hydroxykynurenine ChemIDplus
Database Links Databases
3-HYDROXY-L-KYNURENINE MetaCyc
C00007443 KNApSAcK
C03227 KEGG COMPOUND
YMDB00105 YMDB
View more database links
Registry Number Type Source
606-14-4 CAS Registry Number ChemIDplus
Last Modified
27 January 2016