EMBL-EBI | Chemical Biology | ChEBI

Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search

CHEBI:15727 - carnosine

ChEBI IDCHEBI:15727
ChEBI Namecarnosine
Stars
DefinitionA dipeptide that is the N-(β-alanyl) derivative of L-histidine.
Secondary ChEBI IDsCHEBI:3428, CHEBI:13948, CHEBI:23040
Last Modified23 September 2021
DownloadsMolfile

FormulaC9H14N4O3
Net Charge0
Average Mass226.236
Monoisotopic Mass226.10659
SMILESNCCC(=O)N[C@@H](Cc1cncn1)C(=O)O
InChIInChI=1S/C9H14N4O3/c10-2-1-8(14)13-7(9(15)16)3-6-4-11-5-12-6/h4-5,7H,1-3,10H2,(H,11,12)(H,13,14)(H,15,16)/t7-/m0/s1
InChIKeyCQOVPNPJLQNMDC-ZETCQYMHSA-N

Wikipedia
Species of MetaboliteComponentSourceComments
Homo sapiens (ncbitaxon:9606) - DOI (10.1038/nbt.2488)
Daphnia magna (ncbitaxon:35525) - Article (Mixtures of similarly acting compounds in Daphnia magna: From gene to metabolite and beyondTine Vandenbrouck, Oliver A.H. Jones, Nathalie Dom, Julian L. Griffin, Wim De CoenEnvironment International 36 (2010) 254-268)
Mus musculus (ncbitaxon:10090) - PubMed (19425150) Source: BioModels - MODEL1507180067
Roles Classification

ChEBI Ontology
IUPAC Name 
Nα-(β-alanyl)-L-histidine
Synonyms  Source
CarnosineKEGG COMPOUND
Nalpha-(beta-alanyl)-L-histidineKEGG COMPOUND
L-carnosineChemIDplus
N-2-MChemIDplus
beta-alanyl-L-histidineChEBI
N-β-alanyl-L-histidineHMDB
Brand Names  Source
KarnozinChemIDplus
KarnozznChemIDplus
Manual XrefsDatabases
C00386KEGG COMPOUND
CarnosineWikipedia
HMDB0000033HMDB
8V0PDBeChem
DB11695DrugBank
388363ChemSpider
C00052222KNApSAcK
Registry NumbersSources
Reaxys:87671Reaxys
CAS:305-84-0KEGG COMPOUND
CAS:305-84-0ChemIDplus
Citations