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CHEBI:136623 - N-octadecanoylglycine

ChEBI IDCHEBI:136623
ChEBI NameN-octadecanoylglycine
Stars
ASCII NameN-octadecanoylglycine
DefinitionA fatty acid amide resulting from the formal condensation of the carboxy group of octadecanoic acid with the amino group of glycine.
Last Modified22 March 2017
SubmitterSteve
DownloadsMolfile
FormulaC20H39NO3
Net Charge0
Average Mass341.536
Monoisotopic Mass341.29299
SMILESCCCCCCCCCCCCCCCCCC(=O)NCC(=O)O
InChIInChI=1S/C20H39NO3/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-19(22)21-18-20(23)24/h2-18H2,1H3,(H,21,22)(H,23,24)
InChIKeyUEYROBDNFIWNST-UHFFFAOYSA-N
Species of MetaboliteComponentSourceComments
Homo Sapiens (ncbitaxon:9606) - PubMed (20305126)
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-octadecanoylglycine (CHEBI:136623) has functional parent octadecanoic acid (CHEBI:28842)
N-octadecanoylglycine (CHEBI:136623) has role human metabolite (CHEBI:77746)
N-octadecanoylglycine (CHEBI:136623) is a N-acylglycine 18:0 (CHEBI:134151)
N-octadecanoylglycine (CHEBI:136623) is a fatty amide (CHEBI:29348)
N-octadecanoylglycine (CHEBI:136623) is conjugate acid of N-octadecanoylglycinate (CHEBI:134041)
Incoming Relation(s)
N-octadecanoylglycinate (CHEBI:134041) is conjugate base of N-octadecanoylglycine (CHEBI:136623)
IUPAC Name 
N-octadecanoylglycine
Synonyms  Source
octadecanoylglycineChEBI
(octadecanoylamino)acetic acidIUPAC
N-stearoylglycineChEBI
stearoylglycineChEBI
N-stearoyl glycineLIPID MAPS
N-octadecanoyl-glycineLIPID MAPS
Manual XrefsDatabases
LMFA08020077LIPID MAPS
HMDB0013308HMDB
Registry NumbersSources
Reaxys:1801426Reaxys
CAS:6333-54-6ChemIDplus
Citations