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CHEBI:16737 - creatinine

ChEBI IDCHEBI:16737
ChEBI Namecreatinine
Stars
DefinitionA lactam obtained by formal cyclocondensation of creatine. It is a metabolite of creatine.
Secondary ChEBI IDsCHEBI:3910, CHEBI:14029, CHEBI:23406
Last Modified23 October 2015
DownloadsMolfile
FormulaC4H7N3O
Net Charge0
Average Mass113.120
Monoisotopic Mass113.05891
SMILESCN1CC(=O)NC1=N
InChIInChI=1S/C4H7N3O/c1-7-2-3(8)6-4(7)5/h2H2,1H3,(H2,5,6,8)
InChIKeyDDRJAANPRJIHGJ-UHFFFAOYSA-N
Wikipedia
Species of MetaboliteComponentSourceComments
Homo sapiens (ncbitaxon:9606) - DOI (10.1038/nbt.2488)
Mus musculus (ncbitaxon:10090) - PubMed (17190852)
Roles Classification
Biological Role:
human metabolite  Any mammalian metabolite produced during a metabolic reaction in humans (Homo sapiens).
Application:
diagnostic agent  A substance administered to aid diagnosis of a disease.
ChEBI Ontology
Outgoing Relation(s)
creatinine (CHEBI:16737) has functional parent creatine (CHEBI:16919)
creatinine (CHEBI:16737) has role diagnostic agent (CHEBI:33295)
creatinine (CHEBI:16737) has role human metabolite (CHEBI:77746)
creatinine (CHEBI:16737) is a imidazolidinone (CHEBI:55370)
creatinine (CHEBI:16737) is a lactam (CHEBI:24995)
IUPAC Name 
2-imino-1-methylimidazolidin-4-one
Synonyms  Source
CreatinineKEGG COMPOUND
1-MethylglycocyamidineKEGG COMPOUND
1-methylglycocyamidineChEBI
KreatininChEBI
creatininaChEBI
créatinineChEBI
UniProt Name  Source
creatinineUniProt
Manual XrefsDatabases
C00791KEGG COMPOUND
D03600KEGG DRUG
HMDB0000562HMDB
CREATININEMetaCyc
CreatinineWikipedia
Registry NumbersSources
Reaxys:112064Reaxys
CAS:60-27-5KEGG COMPOUND
CAS:60-27-5ChemIDplus
CAS:60-27-5NIST Chemistry WebBook
Citations