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CHEBI:170151 - PE-NMe(16:1(9Z)/20:0)

ChEBI IDCHEBI:170151
ChEBI NamePE-NMe(16:1(9Z)/20:0)
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC42H82NO8P
Net Charge0
Average Mass760.091
Monoisotopic Mass759.57781
SMILESCCCCCC/C=C\CCCCCCCC(=O)OCC(COP(=O)(O)OCCNC)OC(=O)CCCCCCCCCCCCCCCCCCC
InChIInChI=1S/C42H82NO8P/c1-4-6-8-10-12-14-16-18-19-20-21-23-25-27-29-31-33-35-42(45)51-40(39-50-52(46,47)49-37-36-43-3)38-48-41(44)34-32-30-28-26-24-22-17-15-13-11-9-7-5-2/h15,17,40,43H,4-14,16,18-39H2,1-3H3,(H,46,47)/b17-15-
InChIKeyLVEXQNNMTUDGNE-ICFOKQHNSA-N
Species of MetaboliteComponentSourceComments
Mus musculus (ncbitaxon:10090) Hepa-RG cell (BTO:0005736) MetaboLights (MTBLS78) Strain: C57BL/6J [EFO:0000606]
Homo sapiens (ncbitaxon:9606)
Hepa-RG cell (BTO:0005736) MetaboLights (MTBLS78)
HeLa cell;NIH-3T3 cell (BTO:0000944) MetaboLights (MTBLS78)
NIH-3T3 cell (BTO:0000944) MetaboLights (MTBLS78)
HeLa cell (BTO:0000567) MetaboLights (MTBLS78)
ChEBI Ontology
Outgoing Relation(s)
PE-NMe(16:1(9Z)/20:0) (CHEBI:170151) is a phosphatidylethanolamine (CHEBI:16038)
IUPAC Name 
[1-[(Z)-hexadec-9-enoyl]oxy-3-[hydroxy-[2-(methylamino)ethoxy]phosphoryl]oxypropan-2-yl] icosanoate
Manual XrefsDatabases
74849848ChemSpider
HMDB0112974HMDB