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CHEBI:191130 - Pyrrolidinium, 1-[(7r)-7-(acetyloxy)-4-hydroxy-4-oxido-3,5,9-trioxa-4-phosphapentacos-1-yl]-1-methyl-, inner salt

ChEBI IDCHEBI:191130
ChEBI NamePyrrolidinium, 1-[(7r)-7-(acetyloxy)-4-hydroxy-4-oxido-3,5,9-trioxa-4-phosphapentacos-1-yl]-1-methyl-, inner salt
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC28H56NO7P
Net Charge0
Average Mass549.730
Monoisotopic Mass549.37944
SMILESCCCCCCCCCCCCCCCCOC[C@H](COP(=O)([O-])OCC[N+]1(C)CCCC1)OC(C)=O
InChIInChI=1S/C28H56NO7P/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-19-23-33-25-28(36-27(2)30)26-35-37(31,32)34-24-22-29(3)20-17-18-21-29/h28H,4-26H2,1-3H3/t28-/m1/s1
InChIKeyQBLLCUIJMABRFJ-MUUNZHRXSA-N
Species of MetaboliteComponentSourceComments
Rattus norvegicus (ncbitaxon:10116) INS-1 cell (BTO:0002135) MetaboLights (MTBLS3963)
ChEBI Ontology
Outgoing Relation(s)
Pyrrolidinium, 1-[(7r)-7-(acetyloxy)-4-hydroxy-4-oxido-3,5,9-trioxa-4-phosphapentacos-1-yl]-1-methyl-, inner salt (CHEBI:191130) is a glycerophospholipid (CHEBI:37739)
IUPAC Name 
[(2R)-2-acetyloxy-3-hexadecoxypropyl] 2-(1-methylpyrrolidin-1-ium-1-yl)ethyl phosphate
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