EMBL-EBI | Chemical Biology | ChEBI

Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search

CHEBI:64390 - N-hexanoylglycine

ChEBI IDCHEBI:64390
ChEBI NameN-hexanoylglycine
Stars
ASCII NameN-hexanoylglycine
DefinitionAn N-acylglycine in which the acyl group is specified as hexanoyl.
Last Modified11 October 2016
SubmitterSteve
DownloadsMolfile
FormulaC8H15NO3
Net Charge0
Average Mass173.212
Monoisotopic Mass173.10519
SMILESCCCCCC(=O)NCC(=O)O
InChIInChI=1S/C8H15NO3/c1-2-3-4-5-7(10)9-6-8(11)12/h2-6H2,1H3,(H,9,10)(H,11,12)
InChIKeyUPCKIPHSXMXJOX-UHFFFAOYSA-N
Roles Classification
Chemical Role:
Bronsted acid  A molecular entity capable of donating a hydron to an acceptor (Brønsted base).
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)
N-hexanoylglycine (CHEBI:64390) has role metabolite (CHEBI:25212)
N-hexanoylglycine (CHEBI:64390) is a N-acylglycine (CHEBI:16180)
N-hexanoylglycine (CHEBI:64390) is conjugate acid of N-hexanoylglycinate (CHEBI:133580)
Incoming Relation(s)
N-hexanoylglycinate (CHEBI:133580) is conjugate base of N-hexanoylglycine (CHEBI:64390)
IUPAC Name 
N-hexanoylglycine
Synonyms  Source
N-caproylglycineChemIDplus
HexanoylglycineChemIDplus
CaproylglycineHMDB
n-HexanoylglycineHMDB
N-(1-oxohexyl)glycineHMDB
Manual XrefsDatabases
EP226304Patent
EP572167Patent
EP580409Patent
US4757066Patent
EP415598Patent
EP517371Patent
US5559092Patent
US5238917Patent
US5112863Patent
HMDB0000701HMDB
Registry NumbersSources
Reaxys:1773416Reaxys
CAS:24003-67-6ChemIDplus
Citations