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CHEBI:86526 - N-[(13Z)-docosenoyl]-tetradecasphing-4-enine-1-phosphoethanolamine

ChEBI IDCHEBI:86526
ChEBI NameN-[(13Z)-docosenoyl]-tetradecasphing-4-enine-1-phosphoethanolamine
Stars
ASCII NameN-[(13Z)-docosenoyl]-tetradecasphing-4-enine-1-phosphoethanolamine
DefinitionA N-acyltetradecasphingosine-1-phosphoethanolamine in which the acyl group specified is (13Z)-docosenoyl.
Last Modified16 July 2015
Submitternamrata
DownloadsMolfile
FormulaC38H75N2O6P
Net Charge0
Average Mass687.000
Monoisotopic Mass686.53627
SMILES[H][C@@](O)(/C=C/CCCCCCCCC)[C@]([H])(COP(=O)(O)OCCN)NC(=O)CCCCCCCCCCC/C=C\CCCCCCCC
InChIInChI=1S/C38H75N2O6P/c1-3-5-7-9-11-13-14-15-16-17-18-19-20-21-22-24-26-28-30-32-38(42)40-36(35-46-47(43,44)45-34-33-39)37(41)31-29-27-25-23-12-10-8-6-4-2/h15-16,29,31,36-37,41H,3-14,17-28,30,32-35,39H2,1-2H3,(H,40,42)(H,43,44)/b16-15-,31-29+/t36-,37+/m0/s1
InChIKeyWCSTVRHVTJCOOO-ZDZUMMNRSA-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-[(13Z)-docosenoyl]-tetradecasphing-4-enine-1-phosphoethanolamine (CHEBI:86526) has functional parent erucic acid (CHEBI:28792)
N-[(13Z)-docosenoyl]-tetradecasphing-4-enine-1-phosphoethanolamine (CHEBI:86526) is a N-acyltetradecasphingosine-1-phosphoethanolamine (CHEBI:83764)
N-[(13Z)-docosenoyl]-tetradecasphing-4-enine-1-phosphoethanolamine (CHEBI:86526) is a ceramide phosphoethanolamine (36:2) (CHEBI:86525)
IUPAC Name 
2-aminoethyl (2S,3R,4E)-2-{[(13Z)-docos-13-enoyl]amino}-3-hydroxytetradec-4-en-1-yl hydrogen phosphate
Synonyms  Source
PE-Cer(d14:1/22:1(13Z))LIPID MAPS
PE-Cer(d14:1(4E)/22:1(13Z))LIPID MAPS
Manual XrefsDatabases
LMSP03020009LIPID MAPS