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CHEBI:185679 - PG(P-16:0/20:5(5Z,8Z,11Z,14Z,17Z))

ChEBI IDCHEBI:185679
ChEBI NamePG(P-16:0/20:5(5Z,8Z,11Z,14Z,17Z))
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC42H73O9P
Net Charge0
Average Mass753.011
Monoisotopic Mass752.49922
SMILESCC/C=C\C/C=C\C/C=C\C/C=C\C/C=C\CCCC(=O)O[C@H](CO/C=C\CCCCCCCCCCCCCC)COP(=O)(O)OC[C@@H](O)CO
InChIInChI=1S/C42H73O9P/c1-3-5-7-9-11-13-15-17-19-20-21-22-24-26-28-30-32-34-42(45)51-41(39-50-52(46,47)49-37-40(44)36-43)38-48-35-33-31-29-27-25-23-18-16-14-12-10-8-6-4-2/h5,7,11,13,17,19,21-22,26,28,33,35,40-41,43-44H,3-4,6,8-10,12,14-16,18,20,23-25,27,29-32,34,36-39H2,1-2H3,(H,46,47)/b7-5-,13-11-,19-17-,22-21-,28-26-,35-33-/t40-,41+/m0/s1
InChIKeyUUQPRIWGUQRPEB-JRAKPLBISA-N
Species of MetaboliteComponentSourceComments
Mus musculus (ncbitaxon:10090) feces (BTO:0000440) MetaboLights (MTBLS3750) Strain: C57BL/6 Mouse [NCIT:C14424]
ChEBI Ontology
Outgoing Relation(s)
PG(P-16:0/20:5(5Z,8Z,11Z,14Z,17Z)) (CHEBI:185679) is a glycerophosphoglycerols (CHEBI:24360)
IUPAC Name 
[(2R)-1-[[(2S)-2,3-dihydroxypropoxy]-hydroxyphosphoryl]oxy-3-[(Z)-hexadec-1-enoxy]propan-2-yl] (5Z,8Z,11Z,14Z,17Z)-icosa-5,8,11,14,17-pentaenoate
Manual XrefsDatabases
113377743ChemSpider
LMGP04030022LIPID MAPS