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CHEBI:170427 - PE-NMe2(16:0/18:1(9Z))

ChEBI IDCHEBI:170427
ChEBI NamePE-NMe2(16:0/18:1(9Z))
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC41H80NO8P
Net Charge0
Average Mass746.064
Monoisotopic Mass745.56216
SMILESCCCCCCCC/C=C\CCCCCCCC(=O)O[C@H](COC(=O)CCCCCCCCCCCCCCC)COP(=O)(O)OCCN(C)C
InChIInChI=1S/C41H80NO8P/c1-5-7-9-11-13-15-17-19-20-22-24-26-28-30-32-34-41(44)50-39(38-49-51(45,46)48-36-35-42(3)4)37-47-40(43)33-31-29-27-25-23-21-18-16-14-12-10-8-6-2/h19-20,39H,5-18,21-38H2,1-4H3,(H,45,46)/b20-19-/t39-/m1/s1
InChIKeyZSVMWQMKUKDZTH-DPTAKULKSA-N
Species of MetaboliteComponentSourceComments
Homo sapiens (ncbitaxon:9606)
HeLa cell (BTO:0000567) MetaboLights (MTBLS78)
HeLa cell;NIH-3T3 cell (BTO:0000944) MetaboLights (MTBLS78)
NIH-3T3 cell (BTO:0000944) MetaboLights (MTBLS78)
Hepa-RG cell (BTO:0005736) MetaboLights (MTBLS78)
Mus musculus (ncbitaxon:10090) Hepa-RG cell (BTO:0005736) MetaboLights (MTBLS78) Strain: C57BL/6J [EFO:0000606]
ChEBI Ontology
Outgoing Relation(s)
PE-NMe2(16:0/18:1(9Z)) (CHEBI:170427) is a phosphatidylethanolamine (CHEBI:16038)
IUPAC Name 
[(2R)-1-[2-(dimethylamino)ethoxy-hydroxyphosphoryl]oxy-3-hexadecanoyloxypropan-2-yl] (Z)-octadec-9-enoate
Manual XrefsDatabases
HMDB0010568HMDB
7825968ChemSpider
LMGP02010322LIPID MAPS