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CHEBI:185914 - PG(17:1(9Z)/18:4(6Z,9Z,12Z,15Z))

ChEBI IDCHEBI:185914
ChEBI NamePG(17:1(9Z)/18:4(6Z,9Z,12Z,15Z))
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC41H71O10P
Net Charge0
Average Mass754.983
Monoisotopic Mass754.47849
SMILESCC/C=C\C/C=C\C/C=C\C/C=C\CCCCC(=O)O[C@H](COC(=O)CCCCCCC/C=C\CCCCCCC)COP(=O)(O)OC[C@@H](O)CO
InChIInChI=1S/C41H71O10P/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-29-31-33-41(45)51-39(37-50-52(46,47)49-35-38(43)34-42)36-48-40(44)32-30-28-26-24-22-20-18-16-14-12-10-8-6-4-2/h5,7,11,13,16-19,23,25,38-39,42-43H,3-4,6,8-10,12,14-15,20-22,24,26-37H2,1-2H3,(H,46,47)/b7-5-,13-11-,18-16-,19-17-,25-23-/t38-,39+/m0/s1
InChIKeyIEJRFWJHNGWRLU-JMGXWWQKSA-N
Species of MetaboliteComponentSourceComments
Mus musculus (ncbitaxon:10090) feces (BTO:0000440) MetaboLights (MTBLS3750) Strain: C57BL/6 Mouse [NCIT:C14424]
Roles Classification
Biological Roles:
Escherichia coli metabolite  Any bacterial metabolite produced during a metabolic reaction in Escherichia coli.
mouse metabolite  Any mammalian metabolite produced during a metabolic reaction in a mouse (Mus musculus).
ChEBI Ontology
Outgoing Relation(s)
PG(17:1(9Z)/18:4(6Z,9Z,12Z,15Z)) (CHEBI:185914) is a phosphatidylglycerol (CHEBI:17517)
IUPAC Name 
[(2R)-1-[[(2S)-2,3-dihydroxypropoxy]-hydroxyphosphoryl]oxy-3-[(Z)-heptadec-9-enoyl]oxypropan-2-yl] (6Z,9Z,12Z,15Z)-octadeca-6,9,12,15-tetraenoate
Manual XrefsDatabases
113377003ChemSpider
LMGP04010263LIPID MAPS