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CHEBI:73788 - Ala-Gln

ChEBI IDCHEBI:73788
ChEBI NameAla-Gln
Stars
DefinitionA dipeptide formed from L-alanyl and L-glutamine residues.
Last Modified22 February 2017
SubmitterSteve
DownloadsMolfile
FormulaC8H15N3O4
Net Charge0
Average Mass217.225
Monoisotopic Mass217.10626
SMILESC[C@H](N)C(=O)N[C@@H](CCC(N)=O)C(=O)O
InChIInChI=1S/C8H15N3O4/c1-4(9)7(13)11-5(8(14)15)2-3-6(10)12/h4-5H,2-3,9H2,1H3,(H2,10,12)(H,11,13)(H,14,15)/t4-,5-/m0/s1
InChIKeyHJCMDXDYPOUFDY-WHFBIAKZSA-N
Roles Classification
Chemical Role:
Bronsted base  A molecular entity capable of accepting a hydron from a donor (Brønsted acid).
Biological Role:
metabolite  Any intermediate or product resulting from metabolism. The term 'metabolite' subsumes the classes commonly known as primary and secondary metabolites.
ChEBI Ontology
Outgoing Relation(s)
Ala-Gln (CHEBI:73788) has role metabolite (CHEBI:25212)
Ala-Gln (CHEBI:73788) is a dipeptide (CHEBI:46761)
Ala-Gln (CHEBI:73788) is tautomer of Ala-Gln zwitterion (CHEBI:74387)
Incoming Relation(s)
Ala-Gln zwitterion (CHEBI:74387) is tautomer of Ala-Gln (CHEBI:73788)
IUPAC Name 
L-alanyl-L-glutamine
Synonyms  Source
AQChEBI
L-Ala-L-GlnChEBI
alanylglutamineChEBI
Alanyl-GlutamineHMDB
Manual XrefsDatabases
HMDB0028685HMDB
CPD-13403MetaCyc
4319DrugCentral
Registry NumbersSources
Reaxys:2417888Reaxys
CAS:39537-23-0ChemIDplus
Citations