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CHEBI:191918 - PE-Cer(d14:2(4E,6E)/19:0)

ChEBI IDCHEBI:191918
ChEBI NamePE-Cer(d14:2(4E,6E)/19:0)
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC35H69N2O6P
Net Charge0
Average Mass644.919
Monoisotopic Mass644.48932
SMILESCCCCCCC/C=C/C=C/[C@@H](O)[C@H](COP(=O)(O)OCCN)NC(=O)CCCCCCCCCCCCCCCCCC
InChIInChI=1S/C35H69N2O6P/c1-3-5-7-9-11-13-14-15-16-17-18-19-21-23-25-27-29-35(39)37-33(32-43-44(40,41)42-31-30-36)34(38)28-26-24-22-20-12-10-8-6-4-2/h22,24,26,28,33-34,38H,3-21,23,25,27,29-32,36H2,1-2H3,(H,37,39)(H,40,41)/b24-22+,28-26+/t33-,34+/m0/s1
InChIKeyCKKDLMNKUBVQFV-YKENKANRSA-N
Species of MetaboliteComponentSourceComments
Mus musculus (ncbitaxon:10090) blood serum (BTO:0000133) MetaboLights (MTBLS4638)
ChEBI Ontology
Outgoing Relation(s)
PE-Cer(d14:2(4E,6E)/19:0) (CHEBI:191918) is a phosphoethanolamine (CHEBI:36711)
IUPAC Name 
2-aminoethyl [(2S,3R,4E,6E)-3-hydroxy-2-(nonadecanoylamino)tetradeca-4,6-dienyl] hydrogen phosphate
Manual XrefsDatabases
LMSP03020039LIPID MAPS
113381590ChemSpider