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CHEBI:184606 - (2-Aminoethoxy)[(2R)-2-[(1Z)-hexadec-1-en-1-yloxy]-3-(pentadecanoyloxy)propoxy]phosphinic acid

ChEBI IDCHEBI:184606
ChEBI Name(2-Aminoethoxy)[(2R)-2-[(1Z)-hexadec-1-en-1-yloxy]-3-(pentadecanoyloxy)propoxy]phosphinic acid
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC36H72NO7P
Net Charge0
Average Mass661.946
Monoisotopic Mass661.50464
SMILESCCCCCCCCCCCCCC/C=C\O[C@H](COC(=O)CCCCCCCCCCCCCC)COP(=O)(O)OCCN
InChIInChI=1S/C36H72NO7P/c1-3-5-7-9-11-13-15-17-18-20-22-24-26-28-31-41-35(34-44-45(39,40)43-32-30-37)33-42-36(38)29-27-25-23-21-19-16-14-12-10-8-6-4-2/h28,31,35H,3-27,29-30,32-34,37H2,1-2H3,(H,39,40)/b31-28-/t35-/m1/s1
InChIKeyUBSQUFRHLMOAJH-HWZZGRHZSA-N
Species of MetaboliteComponentSourceComments
Bos taurus (ncbitaxon:9913) spermatozoon (BTO:0001277) MetaboLights (MTBLS1071) Strain: Holstein [LBO:0000132]
ChEBI Ontology
Outgoing Relation(s)
(2-Aminoethoxy)[(2R)-2-[(1Z)-hexadec-1-en-1-yloxy]-3-(pentadecanoyloxy)propoxy]phosphinic acid (CHEBI:184606) is a glycerophosphoethanolamine (CHEBI:36314)
IUPAC Name 
[(2R)-3-[2-aminoethoxy(hydroxy)phosphoryl]oxy-2-[(Z)-hexadec-1-enoxy]propyl] pentadecanoate
Manual XrefsDatabases
24768418ChemSpider
HMDB0008916HMDB