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CHEBI:133641 - Ile-Gly zwitterion

ChEBI IDCHEBI:133641
ChEBI NameIle-Gly zwitterion
Stars
DefinitionA dipeptide zwitterion obtained by transfer of a proton from the carboxy to the amino terminus of Ile-Gly. Major species at pH 7.3.
Last Modified13 October 2016
Submitterjjtluanloet
DownloadsMolfile
FormulaC8H16N2O3
Net Charge0
Average Mass188.227
Monoisotopic Mass188.11609
SMILESCC[C@H](C)[C@H]([NH3+])C(=O)NCC(=O)[O-]
InChIInChI=1S/C8H16N2O3/c1-3-5(2)7(9)8(13)10-4-6(11)12/h5,7H,3-4,9H2,1-2H3,(H,10,13)(H,11,12)/t5-,7-/m0/s1
InChIKeyUCGDDTHMMVWVMV-FSPLSTOPSA-N
Roles Classification
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)
Ile-Gly zwitterion (CHEBI:133641) has role metabolite (CHEBI:25212)
Ile-Gly zwitterion (CHEBI:133641) is a dipeptide zwitterion (CHEBI:90799)
Ile-Gly zwitterion (CHEBI:133641) is tautomer of Ile-Gly (CHEBI:74066)
Incoming Relation(s)
Ile-Gly (CHEBI:74066) is tautomer of Ile-Gly zwitterion (CHEBI:133641)
IUPAC Name 
{[(2S,3S)-2-azaniumyl-3-methylpentanoyl]amino}acetate
Synonyms  Source
L-Ile-Gly zwitterionChEBI
isoleucylglycine zwitterionChEBI
L-isoleucylglycine zwitterionChEBI