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CHEBI:185446 - PG(O-16:0/18:1(9Z))

ChEBI IDCHEBI:185446
ChEBI NamePG(O-16:0/18:1(9Z))
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC40H79O9P
Net Charge0
Average Mass735.037
Monoisotopic Mass734.54617
SMILESCCCCCCCC/C=C\CCCCCCCC(=O)O[C@H](COCCCCCCCCCCCCCCCC)COP(=O)(O)OC[C@@H](O)CO
InChIInChI=1S/C40H79O9P/c1-3-5-7-9-11-13-15-17-19-20-22-24-26-28-30-32-40(43)49-39(37-48-50(44,45)47-35-38(42)34-41)36-46-33-31-29-27-25-23-21-18-16-14-12-10-8-6-4-2/h17,19,38-39,41-42H,3-16,18,20-37H2,1-2H3,(H,44,45)/b19-17-/t38-,39+/m0/s1
InChIKeyVODQFHVPFFGTIS-KOXHLKJNSA-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(O-16:0/18:1(9Z)) (CHEBI:185446) is a glycerophosphoglycerols (CHEBI:24360)
IUPAC Name 
[(2R)-1-[[(2S)-2,3-dihydroxypropoxy]-hydroxyphosphoryl]oxy-3-hexadecoxypropan-2-yl] (Z)-octadec-9-enoate
Manual XrefsDatabases
LMGP04020092LIPID MAPS
113377720ChemSpider