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CHEBI:187015 - PG(22:2(13Z,16Z)/0:0)

ChEBI IDCHEBI:187015
ChEBI NamePG(22:2(13Z,16Z)/0:0)
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC28H53O9P
Net Charge0
Average Mass564.697
Monoisotopic Mass564.34272
SMILESCCCCC/C=C\C/C=C\CCCCCCCCCCCC(=O)OC[C@@H](O)COP(=O)(O)OC[C@@H](O)CO
InChIInChI=1S/C28H53O9P/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-28(32)35-23-27(31)25-37-38(33,34)36-24-26(30)22-29/h6-7,9-10,26-27,29-31H,2-5,8,11-25H2,1H3,(H,33,34)/b7-6-,10-9-/t26-,27+/m0/s1
InChIKeyOVSIODCMSUUMOS-XFNLLIJISA-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(22:2(13Z,16Z)/0:0) (CHEBI:187015) is a glycerophosphoglycerols (CHEBI:24360)
IUPAC Name 
[(2R)-3-[[(2S)-2,3-dihydroxypropoxy]-hydroxyphosphoryl]oxy-2-hydroxypropyl] (13Z,16Z)-docosa-13,16-dienoate
Manual XrefsDatabases
113377830ChemSpider
LMGP04050027LIPID MAPS