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

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ChEBI Name	5,5-dimethyl-1-pyrroline N-oxide

ChEBI ID	CHEBI:149489

ChEBI ASCII Name	5,5-dimethyl-1-pyrroline N-oxide

Definition	A 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.

Stars	This entity has been manually annotated by the ChEBI Team.

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Formula

C6H11NO

Net Charge

Average Mass

113.160

Monoisotopic Mass

113.08406

InChI

InChI=1S/C6H11NO/c1-6(2)4-3-5-7(6)8/h5H,3-4H2,1-2H3

InChIKey

VCUVETGKTILCLC-UHFFFAOYSA-N

SMILES

C1([N+](=CCC1)[O-])(C)C

Roles Classification
Application(s):	neuroprotective agent Any compound that can be used for the treatment of neurodegenerative disorders. 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.

ChEBI Ontology
Outgoing	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

Registry Number	Type	Source
3317-61-1	CAS Registry Number	ChemIDplus

Last Modified

17 April 2020