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CHEBI:171196 - PE-NMe2(20:5(5Z,8Z,11Z,14Z,17Z)/15:0)

ChEBI IDCHEBI:171196
ChEBI NamePE-NMe2(20:5(5Z,8Z,11Z,14Z,17Z)/15:0)
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC42H74NO8P
Net Charge0
Average Mass752.027
Monoisotopic Mass751.51520
SMILESCC/C=C\C/C=C\C/C=C\C/C=C\C/C=C\CCCC(=O)OCC(COP(=O)(O)OCCN(C)C)OC(=O)CCCCCCCCCCCCCC
InChIInChI=1S/C42H74NO8P/c1-5-7-9-11-13-15-17-19-20-21-22-23-25-26-28-30-32-34-41(44)48-38-40(39-50-52(46,47)49-37-36-43(3)4)51-42(45)35-33-31-29-27-24-18-16-14-12-10-8-6-2/h7,9,13,15,19-20,22-23,26,28,40H,5-6,8,10-12,14,16-18,21,24-25,27,29-39H2,1-4H3,(H,46,47)/b9-7-,15-13-,20-19-,23-22-,28-26-
InChIKeyCSTYWYRKVWOIDP-ZOMLDSRTSA-N
Species of MetaboliteComponentSourceComments
Homo sapiens (ncbitaxon:9606)
Hepa-RG cell (BTO:0005736) MetaboLights (MTBLS78)
HeLa cell;NIH-3T3 cell (BTO:0000944) MetaboLights (MTBLS78)
HeLa cell (BTO:0000567) MetaboLights (MTBLS78)
NIH-3T3 cell (BTO:0000944) 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(20:5(5Z,8Z,11Z,14Z,17Z)/15:0) (CHEBI:171196) is a phosphatidylethanolamine (CHEBI:16038)
IUPAC Name 
[3-[2-(dimethylamino)ethoxy-hydroxyphosphoryl]oxy-2-pentadecanoyloxypropyl] (5Z,8Z,11Z,14Z,17Z)-icosa-5,8,11,14,17-pentaenoate
Manual XrefsDatabases
HMDB0114383HMDB
74851170ChemSpider