CHEBI:62214 - 5-hydroxykynurenaminium(1+)

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
ChEBI Name 5-hydroxykynurenaminium(1+)
ChEBI ID CHEBI:62214
Definition An ammonium ion that is the conjugate base of 5-hydroxykynurenamine, arising from selective protonation of the primary alkylamino function; major species at pH 7.3.
Stars This entity has been manually annotated by the ChEBI Team.
Submitter Anne Morgat
Supplier Information
Download Molfile XML SDF
Formula C9H13N2O2
Net Charge +1
Average Mass 181.21170
Monoisotopic Mass 181.09715
InChI InChI=1S/C9H12N2O2/c10-4-3-9(13)7-5-6(12)1-2-8(7)11/h1-2,5,12H,3-4,10-11H2/p+1
InChIKey JANBBPTXDKFOQR-UHFFFAOYSA-O
SMILES Nc1ccc(O)cc1C(=O)CC[NH3+]
ChEBI Ontology
Outgoing 5-hydroxykynurenaminium(1+) (CHEBI:62214) is a ammonium ion derivative (CHEBI:35274)
5-hydroxykynurenaminium(1+) (CHEBI:62214) is conjugate acid of 5-hydroxykynurenamine (CHEBI:28715)
Incoming 5-hydroxykynurenamine (CHEBI:28715) is conjugate base of 5-hydroxykynurenaminium(1+) (CHEBI:62214)
IUPAC Name
3-(2-amino-5-hydroxyphenyl)-3-oxopropan-1-aminium
Synonyms Sources
5-hydroxykynurenamine UniProt
5-hydroxykynurenamine(1+) ChEBI
5-hydroxykynurenaminium cation ChEBI
Last Modified
26 May 2011
Submitter Remark
2011-05-26 11:40:22.0 Anne Morgat is_a_conjugate_base_of CHEBI:28715 (status OK; requested update in sf)
2011-05-26 11:40:03.0 Anne Morgat