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CHEBI:86528 - N-(tricosanoyl)-[(4E,6E)-tetradecasphingadienine]-1-phosphoethanolamine

ChEBI IDCHEBI:86528
ChEBI NameN-(tricosanoyl)-[(4E,6E)-tetradecasphingadienine]-1-phosphoethanolamine
Stars
ASCII NameN-(tricosanoyl)-[(4E,6E)-tetradecasphingadienine]-1-phosphoethanolamine
DefinitionA ceramide phosphoethanolamine (37:2) in which the acyl and sphingoid base specified is tricosanoyl and (4E,6E)-tetradecasphingadienine respectively.
Last Modified16 July 2015
Submitternamrata
DownloadsMolfile
FormulaC39H77N2O6P
Net Charge0
Average Mass701.027
Monoisotopic Mass700.55192
SMILES[H][C@@](O)(/C=C/C=C/CCCCCCC)[C@]([H])(COP(=O)(O)OCCN)NC(=O)CCCCCCCCCCCCCCCCCCCCCC
InChIInChI=1S/C39H77N2O6P/c1-3-5-7-9-11-13-14-15-16-17-18-19-20-21-22-23-25-27-29-31-33-39(43)41-37(36-47-48(44,45)46-35-34-40)38(42)32-30-28-26-24-12-10-8-6-4-2/h26,28,30,32,37-38,42H,3-25,27,29,31,33-36,40H2,1-2H3,(H,41,43)(H,44,45)/b28-26+,32-30+/t37-,38+/m0/s1
InChIKeyGHOYZKFJGQWFEZ-IGUKYYCESA-N
Roles Classification
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-(tricosanoyl)-[(4E,6E)-tetradecasphingadienine]-1-phosphoethanolamine (CHEBI:86528) has functional parent tricosanoic acid (CHEBI:42394)
N-(tricosanoyl)-[(4E,6E)-tetradecasphingadienine]-1-phosphoethanolamine (CHEBI:86528) is a ceramide phosphoethanolamine (37:2) (CHEBI:86527)
IUPAC Name 
2-aminoethyl (2S,3R,4E,6E)-3-hydroxy-2-(tricosanoylamino)tetradeca-4,6-dien-1-yl hydrogen phosphate
Synonym  Source
PE-Cer(d14:2(4E,6E)/23:0)LIPID MAPS
Manual XrefsDatabases
LMSP03020041LIPID MAPS