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CHEBI:9675 - triazolealanine

ChEBI IDCHEBI:9675
ChEBI Nametriazolealanine
Stars
DefinitionA non-proteinogenic α-amino acid that is alanine in which one of the methyl hydrogens is replaced by a 1,2,4-triazol-3-yl group.
Last Modified28 November 2014
DownloadsMolfile
FormulaC5H8N4O2
Net Charge0
Average Mass156.145
Monoisotopic Mass156.06473
SMILESNC(Cc1ncnn1)C(=O)O
InChIInChI=1S/C5H8N4O2/c6-3(5(10)11)1-4-7-2-8-9-4/h2-3H,1,6H2,(H,10,11)(H,7,8,9)
InChIKeyCAPORZWUTKSILW-UHFFFAOYSA-N
Roles Classification
Chemical Roles:
Bronsted base  A molecular entity capable of accepting a hydron from a donor (Brønsted acid).
Bronsted acid  A molecular entity capable of donating a hydron to an acceptor (Brønsted base).
ChEBI Ontology
Outgoing Relation(s)
triazolealanine (CHEBI:9675) is a non-proteinogenic α-amino acid (CHEBI:83925)
triazolealanine (CHEBI:9675) is a triazoles (CHEBI:35727)
IUPAC Name 
3-(1H-1,2,4-triazol-3-yl)alanine
Synonyms  Source
1,2,4-Triazole-3-alanineKEGG COMPOUND
alpha-Amino-1H-1,2,4-triazole-3-propanoic acidChemIDplus
1,2,4-Triazolyl-3-alanineChemIDplus
3-(1,2,4-triazol-3-yl)alanineChEBI
Manual XrefsDatabases
C11345KEGG COMPOUND
Registry NumbersSources
CAS:10109-05-4KEGG COMPOUND
CAS:10109-05-4ChemIDplus
Citations