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CHEBI:149489 - 5,5-dimethyl-1-pyrroline N-oxide

Default Structure
ChEBI IDCHEBI:149489
ChEBI Name5,5-dimethyl-1-pyrroline N-oxide
Stars
ASCII Name5,5-dimethyl-1-pyrroline N-oxide
DefinitionA member of the class of 1-pyrroline nitrones (1-pyrroline N-oxides) resulting from the formal N-oxidation of 5,5-dimethyl-1-pyrroline. Used as a spin trap for the study of radicals formed by enzymatic acetaldehyde oxidation.
Last Modified17 April 2020
SubmitterGareth Owen
DownloadsMolfile
FormulaC6H11NO
Net Charge0
Average Mass113.160
Monoisotopic Mass113.08406
SMILESCC1(C)CCC=[N+]1[O-]
InChIInChI=1S/C6H11NO/c1-6(2)4-3-5-7(6)8/h5H,3-4H2,1-2H3
InChIKeyVCUVETGKTILCLC-UHFFFAOYSA-N
Roles Classification
Applications:
spin trapping reagent  A reagent used in electron paramagnetic resonance (EPR) spectroscopy to react covalently with radical products whose half-life is be too short to detect. The resulting adducts are more stable enabling their paramagnetic resonance spectra to be obtained.
neuroprotective agent  Any compound that can be used for the treatment of neurodegenerative disorders.
ChEBI Ontology
Outgoing Relation(s)
5,5-dimethyl-1-pyrroline N-oxide (CHEBI:149489) has functional parent 5,5-dimethyl-1-pyrroline (CHEBI:149492)
5,5-dimethyl-1-pyrroline N-oxide (CHEBI:149489) has role neuroprotective agent (CHEBI:63726)
5,5-dimethyl-1-pyrroline N-oxide (CHEBI:149489) has role spin trapping reagent (CHEBI:149497)
5,5-dimethyl-1-pyrroline N-oxide (CHEBI:149489) is a 1-pyrroline nitrones (CHEBI:149491)
IUPAC Name 
2,2-dimethyl-3,4-dihydro-2H-pyrrole 1-oxide
Synonyms  Source
5,5-dimethyl-1-pyrroline-1-oxideChEBI
5,5-dimethyl-1-pyrroline N-oxideChemIDplus
5,5-dimethyl-1-pyrroline nitroneChEBI
5,5-dimethylpyrroline-N-oxideChemIDplus
DMPOChEBI
Registry NumbersSources
CAS:3317-61-1ChemIDplus
Citations