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CHEBI:230364 - N-Docosahexaenoyl Lysine

ChEBI IDCHEBI:230364
ChEBI NameN-Docosahexaenoyl Lysine
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC28H44N2O3
Net Charge0
Average Mass456.671
Monoisotopic Mass456.33519
SMILESCC/C=C/C/C=C/C/C=C/C/C=C/C/C=C/C/C=C/CCC(=O)NC(CCCCN)C(=O)O
InChIInChI=1S/C28H44N2O3/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-24-27(31)30-26(28(32)33)23-21-22-25-29/h3-4,6-7,9-10,12-13,15-16,18-19,26H,2,5,8,11,14,17,20-25,29H2,1H3,(H,30,31)(H,32,33)/b4-3+,7-6+,10-9+,13-12+,16-15+,19-18+
InChIKeyBHNFJIKHRDWGLL-SFGLVEFQSA-N
Species of MetaboliteComponentSourceComments
Mus musculus (ncbitaxon:10090) feces (BTO:0000440) MetaboLights (MTBLS9100)
Roles Classification
Chemical Role:
Bronsted acid  A molecular entity capable of donating a hydron to an acceptor (Brønsted base).
ChEBI Ontology
Outgoing Relation(s)
N-Docosahexaenoyl Lysine (CHEBI:230364) is a N-acyl-amino acid (CHEBI:51569)
IUPAC Name 
6-amino-2-[[(4E,7E,10E,13E,16E,19E)-docosa-4,7,10,13,16,19-hexaenoyl]amino]hexanoic acid
Manual XrefsDatabases
128530272ChemSpider