CHEBI:58125 - 3-hydroxy-L-kynurenine zwitterion

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
ChEBI Name 3-hydroxy-L-kynurenine zwitterion
ChEBI ID CHEBI:58125
ChEBI ASCII Name 3-hydroxy-L-kynurenine zwitterion
Definition Zwitterionic form of 3-hydroxy-L-kynurenine arising from transfer of a proton from the carboxy to the amino group; major species at pH 7.3
Stars This entity has been manually annotated by the ChEBI Team.
Supplier Information
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Formula C10H12N2O4
Net Charge 0
Average Mass 224.21330
Monoisotopic Mass 224.07971
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 Nc1c(O)cccc1C(=O)C[C@H]([NH3+])C([O-])=O
ChEBI Ontology
Outgoing 3-hydroxy-L-kynurenine zwitterion (CHEBI:58125) is a amino acid zwitterion (CHEBI:35238)
3-hydroxy-L-kynurenine zwitterion (CHEBI:58125) is enantiomer of 3-hydroxy-D-kynurenine zwitterion (CHEBI:141610)
3-hydroxy-L-kynurenine zwitterion (CHEBI:58125) is tautomer of 3-hydroxy-L-kynurenine (CHEBI:17380)
Incoming 3-hydroxy-4-methyl-L-kynurenine zwitterion (CHEBI:141609) has functional parent 3-hydroxy-L-kynurenine zwitterion (CHEBI:58125)
3-hydroxy-D-kynurenine zwitterion (CHEBI:141610) is enantiomer of 3-hydroxy-L-kynurenine zwitterion (CHEBI:58125)
3-hydroxy-L-kynurenine (CHEBI:17380) is tautomer of 3-hydroxy-L-kynurenine zwitterion (CHEBI:58125)
IUPAC Name
(2S)-4-(2-amino-3-hydroxyphenyl)-2-azaniumyl-4-oxobutanoate
Synonym Source
3-hydroxy-L-kynurenine UniProt
Last Modified
30 October 2017