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CHEBI:168673 - PG(O-16:0/0:0)

ChEBI IDCHEBI:168673
ChEBI NamePG(O-16:0/0:0)
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC22H47O8P
Net Charge0
Average Mass470.584
Monoisotopic Mass470.30086
SMILESCCCCCCCCCCCCCCCCOC[C@@H](O)COP(=O)(O)OC[C@@H](O)CO
InChIInChI=1S/C22H47O8P/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-28-18-22(25)20-30-31(26,27)29-19-21(24)17-23/h21-25H,2-20H2,1H3,(H,26,27)/t21-,22+/m0/s1
InChIKeyNSJPSUNAUBAKMH-FCHUYYIVSA-N
Species of MetaboliteComponentSourceComments
Malus domestica (ncbitaxon:3750) exocarp (BTO:0000733) MetaboLights (MTBLS2384) Strain: Malus x domestica Borkh. cv. Ruixue
ChEBI Ontology
Outgoing Relation(s)
PG(O-16:0/0:0) (CHEBI:168673) is a glycerophosphoglycerols (CHEBI:24360)
IUPAC Name 
[(2S)-2,3-dihydroxypropyl] [(2R)-3-hexadecoxy-2-hydroxypropyl] hydrogen phosphate
Manual XrefsDatabases
9714838ChemSpider
LMGP04060003LIPID MAPS