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CHEBI:7563 - N-nicotinoylglycine

ChEBI IDCHEBI:7563
ChEBI NameN-nicotinoylglycine
Stars
ASCII NameN-nicotinoylglycine
DefinitionAn N-acylglycine having nicotinoyl as the acyl substituent.
Last Modified23 October 2015
DownloadsMolfile
FormulaC8H8N2O3
Net Charge0
Average Mass180.163
Monoisotopic Mass180.05349
SMILESO=C(O)CNC(=O)c1cccnc1
InChIInChI=1S/C8H8N2O3/c11-7(12)5-10-8(13)6-2-1-3-9-4-6/h1-4H,5H2,(H,10,13)(H,11,12)
InChIKeyZBSGKPYXQINNGF-UHFFFAOYSA-N
Roles Classification
Chemical Role:
Bronsted acid  A molecular entity capable of donating a hydron to an acceptor (Brønsted base).
Biological Role:
human urinary metabolite  Any metabolite (endogenous or exogenous) found in human urine samples.
ChEBI Ontology
Outgoing Relation(s)
N-nicotinoylglycine (CHEBI:7563) has role human urinary metabolite (CHEBI:84087)
N-nicotinoylglycine (CHEBI:7563) is a N-acylglycine (CHEBI:16180)
Synonyms  Source
NicotinurateKEGG COMPOUND
Nicotinuric acidKEGG COMPOUND
NicotinylglycineKEGG COMPOUND
N-NicotinylglycineChemIDplus
NicotinoylglycineChemIDplus
N-(Pyridin-3-ylcarbonyl)glycineChemIDplus
Manual XrefsDatabases
C05380KEGG COMPOUND
HMDB0003269HMDB
Registry NumbersSources
Reaxys:8859Reaxys
CAS:583-08-4KEGG COMPOUND
CAS:583-08-4ChemIDplus
Citations