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CHEBI:86366 - N-(2-methylbutanoyl)glycine

ChEBI IDCHEBI:86366
ChEBI NameN-(2-methylbutanoyl)glycine
Stars
ASCII NameN-(2-methylbutanoyl)glycine
DefinitionA N-acylglycine that is glycine substituted by a 2-methylbutanoyl group at the N atom.
Last Modified12 March 2018
Submitternamrata
DownloadsMolfile
FormulaC7H13NO3
Net Charge0
Average Mass159.185
Monoisotopic Mass159.08954
SMILESCCC(C)C(=O)NCC(=O)O
InChIInChI=1S/C7H13NO3/c1-3-5(2)7(11)8-4-6(9)10/h5H,3-4H2,1-2H3,(H,8,11)(H,9,10)
InChIKeyHOACIBQKYRHBOW-UHFFFAOYSA-N
Species of MetaboliteComponentSourceComments
Homo sapiens (ncbitaxon:9606) - PubMed (24023812)
Roles Classification
Chemical Role:
Bronsted acid  A molecular entity capable of donating a hydron to an acceptor (Brønsted base).
Biological Role:
human metabolite  Any mammalian metabolite produced during a metabolic reaction in humans (Homo sapiens).
ChEBI Ontology
Outgoing Relation(s)
N-(2-methylbutanoyl)glycine (CHEBI:86366) has functional parent 2-methylbutyric acid (CHEBI:37070)
N-(2-methylbutanoyl)glycine (CHEBI:86366) has role human metabolite (CHEBI:77746)
N-(2-methylbutanoyl)glycine (CHEBI:86366) is a N-acylglycine (CHEBI:16180)
IUPAC Name 
N-(2-methylbutanoyl)glycine
Synonyms  Source
2-MethylbutyrylglycineHMDB
alpha-MethylbutyrylglycineHMDB
Manual XrefsDatabases
HMDB0000339HMDB
Registry NumbersSources
Reaxys:2206207Reaxys
CAS:52320-67-9ChemIDplus
Citations