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CHEBI:184703 - [2-(methylamino)ethoxy][2-(octadecanoyloxy)-3-[(15Z)-tetracos-15-enoyloxy]propoxy]phosphinic acid

ChEBI IDCHEBI:184703
ChEBI Name[2-(methylamino)ethoxy][2-(octadecanoyloxy)-3-[(15Z)-tetracos-15-enoyloxy]propoxy]phosphinic acid
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC48H94NO8P
Net Charge0
Average Mass844.253
Monoisotopic Mass843.67171
SMILESCCCCCCCC/C=C\CCCCCCCCCCCCCC(=O)OCC(COP(=O)(O)OCCNC)OC(=O)CCCCCCCCCCCCCCCCC
InChIInChI=1S/C48H94NO8P/c1-4-6-8-10-12-14-16-18-20-21-22-23-24-25-27-28-30-32-34-36-38-40-47(50)54-44-46(45-56-58(52,53)55-43-42-49-3)57-48(51)41-39-37-35-33-31-29-26-19-17-15-13-11-9-7-5-2/h18,20,46,49H,4-17,19,21-45H2,1-3H3,(H,52,53)/b20-18-
InChIKeyKBWQYFQWPHSVHQ-ZZEZOPTASA-N
Species of MetaboliteComponentSourceComments
Bos taurus (ncbitaxon:9913) spermatozoon (BTO:0001277) MetaboLights (MTBLS1071) Strain: Holstein [LBO:0000132]
ChEBI Ontology
Outgoing Relation(s)
[2-(methylamino)ethoxy][2-(octadecanoyloxy)-3-[(15Z)-tetracos-15-enoyloxy]propoxy]phosphinic acid (CHEBI:184703) is a phosphatidylethanolamine (CHEBI:16038)
IUPAC Name 
[3-[hydroxy-[2-(methylamino)ethoxy]phosphoryl]oxy-2-octadecanoyloxypropyl] (Z)-tetracos-15-enoate
Manual XrefsDatabases
74850604ChemSpider
HMDB0113733HMDB