CHEBI:2076 - 5-hydroxykynurenine

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ChEBI Name 5-hydroxykynurenine ChEBI ID CHEBI:2076 Definition A hydroxykynurenine that is kynurenine bearing a hydroxy group at the position 5. Stars This entity has been manually annotated by the ChEBI Team. Supplier Information Download Molfile XML SDF Find compounds which contain this structure Find compounds which resemble this structure Take structure to the Advanced Search Formula C10H12N2O4 Net Charge 0 Average Mass 224.21336 Monoisotopic Mass 224.07971 InChI InChI=1S/C10H12N2O4/c11-7-2-1-5(13)3-6(7)9(14)4-8(12)10(15)16/h1-3,8,13H,4,11-12H2,(H,15,16) InChIKey OTDQYOVYQQZAJL-UHFFFAOYSA-N SMILES NC(CC(=O)c1cc(O)ccc1N)C(O)=O Metabolite of Species Details Homo sapiens (NCBI:txid9606) See: DOI Roles Classification Chemical Role(s): Bronsted base A molecular entity capable of accepting a hydron from a donor (Bronsted acid). (via organic amino compound ) Bronsted acid A molecular entity capable of donating a hydron to an acceptor (Bronsted base). (via oxoacid ) Biological Role(s): human metabolite Any mammalian metabolite produced during a metabolic reaction in humans (Homo sapiens). View more via ChEBI Ontology ChEBI Ontology Outgoing 5-hydroxykynurenine (CHEBI:2076) has role human metabolite (CHEBI:77746) 5-hydroxykynurenine (CHEBI:2076) is a hydroxykynurenine (CHEBI:86497) Incoming 5-hydroxy-N-formylkynurenine (CHEBI:2065) has functional parent 5-hydroxykynurenine (CHEBI:2076) 5-hydroxy-L-kynurenine (CHEBI:36408) is a 5-hydroxykynurenine (CHEBI:2076) IUPAC Name 3-(2-amino-5-hydroxybenzoyl)alanine Synonyms Sources 2-amino-4-(2-amino-5-hydroxyphenyl)-4-oxobutanoic acid IUPAC 5-Hydroxykynurenine KEGG COMPOUND Registry Numbers Types Sources 2985859 Reaxys Registry Number Reaxys 720-00-3 CAS Registry Number ChemIDplus Last Modified 15 July 2015