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CHEBI:73756 - methyl 8-[3,5-epidioxy-2-(3-hydroperoxy-1-pentenyl)-cyclopentyl]-octanoate

ChEBI IDCHEBI:73756
ChEBI Namemethyl 8-[3,5-epidioxy-2-(3-hydroperoxy-1-pentenyl)-cyclopentyl]-octanoate
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DefinitionA lipid hydroperoxide that consists of 2,3-dioxabicyclo[2.2.1]heptane substituted by a 11-methoxy-11-oxoundec-1-en-1-yl and a 3-hydroperoxypent-1-en-1-yl groups at positions 5 and 6 respectively.
Last Modified25 August 2020
Submittermwilliams
DownloadsMolfile
FormulaC22H36O6
Net Charge0
Average Mass396.524
Monoisotopic Mass396.25119
SMILES[H]C(=CCCCCCCCCC(=O)OC)C1C2CC(OO2)C1C([H])=CC(CC)OO
InChIInChI=1S/C22H36O6/c1-3-17(26-24)14-15-19-18(20-16-21(19)28-27-20)12-10-8-6-4-5-7-9-11-13-22(23)25-2/h10,12,14-15,17-21,24H,3-9,11,13,16H2,1-2H3
InChIKeySGTSZTLPOBUMKG-UHFFFAOYSA-N
ChEBI Ontology
Outgoing Relation(s)
methyl 8-[3,5-epidioxy-2-(3-hydroperoxy-1-pentenyl)-cyclopentyl]-octanoate (CHEBI:73756) is a fatty acid methyl ester (CHEBI:4986)
methyl 8-[3,5-epidioxy-2-(3-hydroperoxy-1-pentenyl)-cyclopentyl]-octanoate (CHEBI:73756) is a hydroperoxy fatty ester (CHEBI:145037)
IUPAC Name 
methyl 11-{6-[3-hydroperoxypent-1-en-1-yl]-2,3-dioxabicyclo[2.2.1]hept-5-yl}undec-10-enoate
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