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CHEBI:74387 - Ala-Gln zwitterion

ChEBI IDCHEBI:74387
ChEBI NameAla-Gln zwitterion
Stars
DefinitionA peptide zwitterion obtained by transfer of a proton from the carboxy to the amino terminus of Ala-Gln.
Last Modified5 July 2017
SubmitterEugeni Belda
DownloadsMolfile
FormulaC8H15N3O4
Net Charge0
Average Mass217.225
Monoisotopic Mass217.10626
SMILESC[C@H]([NH3+])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
ChEBI Ontology
Outgoing Relation(s)
Ala-Gln zwitterion (CHEBI:74387) is a dipeptide zwitterion (CHEBI:90799)
Ala-Gln zwitterion (CHEBI:74387) is tautomer of Ala-Gln (CHEBI:73788)
Incoming Relation(s)
Ala-Gln (CHEBI:73788) is tautomer of Ala-Gln zwitterion (CHEBI:74387)
IUPAC Name 
(2S)-5-amino-2-{[(2S)-2-azaniumylpropanoyl]amino}-5-oxopentanoate
Synonyms  Source
alanylglutamine zwitterionChEBI
L-alanyl-L-glutamine zwitterionChEBI
L-Ala-L-Gln zwitterionChEBI
AQ zwitterionChEBI
UniProt Name  Source
L-alanyl-L-glutamineUniProt
Manual XrefsDatabases
CPD-13403MetaCyc