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CHEBI:87764 - N-docosanoylglycine

ChEBI IDCHEBI:87764
ChEBI NameN-docosanoylglycine
Stars
ASCII NameN-docosanoylglycine
DefinitionAn N-acylglycine in which the acyl group is specified as docosanoyl.
Last Modified2 September 2015
SubmitterSteve
DownloadsMolfile
FormulaC24H47NO3
Net Charge0
Average Mass397.644
Monoisotopic Mass397.35559
SMILESCCCCCCCCCCCCCCCCCCCCCC(=O)NCC(=O)O
InChIInChI=1S/C24H47NO3/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-23(26)25-22-24(27)28/h2-22H2,1H3,(H,25,26)(H,27,28)
InChIKeyYQPHTLSGFSVOOM-UHFFFAOYSA-N
Species of MetaboliteComponentSourceComments
Homo sapiens (ncbitaxon:9606) - PubMed (12810727)
Roles Classification
Chemical Role:
Bronsted acid  A molecular entity capable of donating a hydron to an acceptor (Brønsted base).
Biological Roles:
human urinary metabolite  Any metabolite (endogenous or exogenous) found in human urine samples.
human blood serum metabolite  Any metabolite (endogenous or exogenous) found in human blood serum samples.
ChEBI Ontology
Outgoing Relation(s)
N-docosanoylglycine (CHEBI:87764) has functional parent docosanoic acid (CHEBI:28941)
N-docosanoylglycine (CHEBI:87764) has role human blood serum metabolite (CHEBI:85234)
N-docosanoylglycine (CHEBI:87764) has role human urinary metabolite (CHEBI:84087)
N-docosanoylglycine (CHEBI:87764) is a N-acylglycine (CHEBI:16180)
N-docosanoylglycine (CHEBI:87764) is a fatty amide (CHEBI:29348)
N-docosanoylglycine (CHEBI:87764) is conjugate acid of N-docosanoylglycinate (CHEBI:87410)
Incoming Relation(s)
N-docosanoylglycinate (CHEBI:87410) is conjugate base of N-docosanoylglycine (CHEBI:87764)
IUPAC Names 
N-behenoylglycine
N-docosanoylglycine
Synonyms  Source
2-docosanamidoacetic acidHMDB
docosanamidoacetic acidHMDB
Manual XrefsDatabases
HMDB0013219HMDB
Registry NumbersSources
Reaxys:2221213Reaxys
Citations