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CHEBI:73788 - Ala-Gln

Default Structure
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.
Applications:
cardiovascular drug  A drug that affects the rate or intensity of cardiac contraction, blood vessel diameter or blood volume.
renoprotective agent  Any compound that is able to prevent damage to the kidneys.
ChEBI Ontology
Outgoing Relation(s)
Ala-Gln (CHEBI:73788) has role cardiovascular drug (CHEBI:35554)
Ala-Gln (CHEBI:73788) has role metabolite (CHEBI:25212)
Ala-Gln (CHEBI:73788) has role renoprotective agent (CHEBI:231911)
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
Ala-glnChEMBL
alanyl glutamineChEMBL
alanylglutamineChEBI
Alanyl glutamineChEMBL
Alanyl-GlutamineHMDB
Alanyl-glutamine dipeptideChEMBL
Manual XrefsDatabases
4319DrugCentral
CPD-13403MetaCyc
HMDB0028685HMDB
Registry NumbersSources
Reaxys:2417888Reaxys
CAS:39537-23-0ChemIDplus
Citations