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CHEBI:187558 - PG(14:1(9Z)/18:3(9Z,12Z,15Z))

ChEBI IDCHEBI:187558
ChEBI NamePG(14:1(9Z)/18:3(9Z,12Z,15Z))
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC38H67O10P
Net Charge0
Average Mass714.918
Monoisotopic Mass714.44718
SMILESCC/C=C\C/C=C\C/C=C\CCCCCCCC(=O)O[C@H](COC(=O)CCCCCCC/C=C\CCCC)COP(=O)(O)OC[C@@H](O)CO
InChIInChI=1S/C38H67O10P/c1-3-5-7-9-11-13-15-16-17-18-20-22-24-26-28-30-38(42)48-36(34-47-49(43,44)46-32-35(40)31-39)33-45-37(41)29-27-25-23-21-19-14-12-10-8-6-4-2/h5,7,10-13,16-17,35-36,39-40H,3-4,6,8-9,14-15,18-34H2,1-2H3,(H,43,44)/b7-5-,12-10-,13-11-,17-16-/t35-,36+/m0/s1
InChIKeyKXHFMVUHXOUNHN-VZDYQWRFSA-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(14:1(9Z)/18:3(9Z,12Z,15Z)) (CHEBI:187558) is a phosphatidylglycerol (CHEBI:17517)
IUPAC Name 
[(2R)-1-[[(2S)-2,3-dihydroxypropoxy]-hydroxyphosphoryl]oxy-3-[(Z)-tetradec-9-enoyl]oxypropan-2-yl] (9Z,12Z,15Z)-octadeca-9,12,15-trienoate
Manual XrefsDatabases
113376875ChemSpider
LMGP04010123LIPID MAPS