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CHEBI:196413 - PE-Cer(d15:2(4E,6E)/22:0)

ChEBI IDCHEBI:196413
ChEBI NamePE-Cer(d15:2(4E,6E)/22:0)
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FormulaC39H77N2O6P
Net Charge0
Average Mass701.027
Monoisotopic Mass700.55192
SMILESCCCCCCCC/C=C/C=C/[C@@H](O)[C@H](COP(=O)(O)OCCN)NC(=O)CCCCCCCCCCCCCCCCCCCCC
InChIInChI=1S/C39H77N2O6P/c1-3-5-7-9-11-13-15-16-17-18-19-20-21-22-23-25-27-29-31-33-39(43)41-37(36-47-48(44,45)46-35-34-40)38(42)32-30-28-26-24-14-12-10-8-6-4-2/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
InChIKeyLNPPDKAZAYXFKF-IGUKYYCESA-N
ChEBI Ontology
Outgoing Relation(s)
PE-Cer(d15:2(4E,6E)/22:0) (CHEBI:196413) is a phosphoethanolamine (CHEBI:36711)
IUPAC Name 
2-aminoethyl [(2S,3R,4E,6E)-2-(docosanoylamino)-3-hydroxypentadeca-4,6-dienyl] hydrogen phosphate
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113381594ChemSpider
LMSP03020045LIPID MAPS