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CHEBI:57747 - 3-(pyrazol-1-yl)-L-alanine zwitterion

ChEBI IDCHEBI:57747
ChEBI Name3-(pyrazol-1-yl)-L-alanine zwitterion
Stars
ASCII Name3-(pyrazol-1-yl)-L-alanine zwitterion
DefinitionZwitterionic form of 3-(pyrazol-1-yl)-L-alanine having an anionic carboxy group and a protonated α-amino group; major species at pH 7.3.
Last Modified15 April 2015
DownloadsMolfile
FormulaC6H9N3O2
Net Charge0
Average Mass155.157
Monoisotopic Mass155.06948
SMILES[NH3+][C@@H](Cn1cccn1)C(=O)[O-]
InChIInChI=1S/C6H9N3O2/c7-5(6(10)11)4-9-3-1-2-8-9/h1-3,5H,4,7H2,(H,10,11)/t5-/m0/s1
InChIKeyPIGOPELHGLPKLL-YFKPBYRVSA-N
ChEBI Ontology
Outgoing Relation(s)
3-(pyrazol-1-yl)-L-alanine zwitterion (CHEBI:57747) is a amino-acid zwitterion (CHEBI:35238)
3-(pyrazol-1-yl)-L-alanine zwitterion (CHEBI:57747) is tautomer of 3-(pyrazol-1-yl)-L-alanine (CHEBI:16357)
Incoming Relation(s)
3-(pyrazol-1-yl)-L-alanine (CHEBI:16357) is tautomer of 3-(pyrazol-1-yl)-L-alanine zwitterion (CHEBI:57747)
IUPAC Name 
(2S)-2-azaniumyl-3-(1H-pyrazol-1-yl)propanoate
Synonym  Source
(2S)-2-ammonio-3-(1H-pyrazol-1-yl)propanoateChEBI
UniProt Name  Source
3-(pyrazol-1-yl)-L-alanineUniProt