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CHEBI:184708 - {2,3-bis[(15Z)-tetracos-15-enoyloxy]propoxy}[2-(dimethylamino)ethoxy]phosphinic acid

ChEBI IDCHEBI:184708
ChEBI Name{2,3-bis[(15Z)-tetracos-15-enoyloxy]propoxy}[2-(dimethylamino)ethoxy]phosphinic acid
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC55H106NO8P
Net Charge0
Average Mass940.426
Monoisotopic Mass939.76561
SMILESCCCCCCCC/C=C\CCCCCCCCCCCCCC(=O)OCC(COP(=O)(O)OCCN(C)C)OC(=O)CCCCCCCCCCCCC/C=C\CCCCCCCC
InChIInChI=1S/C55H106NO8P/c1-5-7-9-11-13-15-17-19-21-23-25-27-29-31-33-35-37-39-41-43-45-47-54(57)61-51-53(52-63-65(59,60)62-50-49-56(3)4)64-55(58)48-46-44-42-40-38-36-34-32-30-28-26-24-22-20-18-16-14-12-10-8-6-2/h19-22,53H,5-18,23-52H2,1-4H3,(H,59,60)/b21-19-,22-20-
InChIKeyRNMLBNWGHWFCFX-WRBBJXAJSA-N
Species of MetaboliteComponentSourceComments
Bos taurus (ncbitaxon:9913) spermatozoon (BTO:0001277) MetaboLights (MTBLS1071) Strain: Holstein [LBO:0000132]
ChEBI Ontology
Outgoing Relation(s)
{2,3-bis[(15Z)-tetracos-15-enoyloxy]propoxy}[2-(dimethylamino)ethoxy]phosphinic acid (CHEBI:184708) is a phosphatidylethanolamine (CHEBI:16038)
IUPAC Name 
[3-[2-(dimethylamino)ethoxy-hydroxyphosphoryl]oxy-2-[(Z)-tetracos-15-enoyl]oxypropyl] (Z)-tetracos-15-enoate
Manual XrefsDatabases
HMDB0114659HMDB
74851446ChemSpider