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CHEBI:184621 - Pe-nme2(18:4(6Z,9Z,12Z,15Z)/14:0)

ChEBI IDCHEBI:184621
ChEBI NamePe-nme2(18:4(6Z,9Z,12Z,15Z)/14:0)
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC39H70NO8P
Net Charge0
Average Mass711.962
Monoisotopic Mass711.48390
SMILESCC/C=C\C/C=C\C/C=C\C/C=C\CCCCC(=O)OCC(COP(=O)(O)OCCN(C)C)OC(=O)CCCCCCCCCCCCC
InChIInChI=1S/C39H70NO8P/c1-5-7-9-11-13-15-17-18-19-20-22-23-25-27-29-31-38(41)45-35-37(36-47-49(43,44)46-34-33-40(3)4)48-39(42)32-30-28-26-24-21-16-14-12-10-8-6-2/h7,9,13,15,18-19,22-23,37H,5-6,8,10-12,14,16-17,20-21,24-36H2,1-4H3,(H,43,44)/b9-7-,15-13-,19-18-,23-22-
InChIKeyAXZGNYXIKBTCLT-RHRNTSNASA-N
Species of MetaboliteComponentSourceComments
Bos taurus (ncbitaxon:9913) spermatozoon (BTO:0001277) MetaboLights (MTBLS1071) Strain: Holstein [LBO:0000132]
ChEBI Ontology
Outgoing Relation(s)
Pe-nme2(18:4(6Z,9Z,12Z,15Z)/14:0) (CHEBI:184621) is a phosphatidylethanolamine (CHEBI:16038)
IUPAC Name 
[3-[2-(dimethylamino)ethoxy-hydroxyphosphoryl]oxy-2-tetradecanoyloxypropyl] (6Z,9Z,12Z,15Z)-octadeca-6,9,12,15-tetraenoate
Manual XrefsDatabases
74850940ChemSpider
HMDB0114152HMDB