5-ethyl-5-methyl-1,3-oxazolidine-2,4-dione (CHEBI:179636)

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ChEBI Name	5-ethyl-5-methyl-1,3-oxazolidine-2,4-dione

ChEBI ID	CHEBI:179636

Definition	An oxazolidinone that is 1,3-oxazolidine-2,4-dione substituted by a methyl and ethyl group at position 5. It is a metabolite of paramethadione.

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

Submitter	MetaboLights Mark Williams

Secondary ChEBI IDs	CHEBI:143436

Supplier Information

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Formula

C6H9NO3

Net Charge

Average Mass

143.142

Monoisotopic Mass

143.05824

InChI

InChI=1S/C6H9NO3/c1-3-6(2)4(8)7-5(9)10-6/h3H2,1-2H3,(H,7,8,9)

InChIKey

MGHNWMRNFGYJKE-UHFFFAOYSA-N

SMILES

CCC1(C)OC(=O)NC1=O

Metabolite of Species	Details
Homo sapiens (NCBI:txid9606)	Found in blood serum (BTO:0000133blood serum). See: PubMed

Roles Classification
Biological Role(s):	drug metabolite human blood serum metabolite Any metabolite (endogenous or exogenous) found in human blood serum samples. human xenobiotic metabolite Any human metabolite produced by metabolism of a xenobiotic compound in humans.

ChEBI Ontology
Outgoing	5-ethyl-5-methyl-1,3-oxazolidine-2,4-dione (CHEBI:179636) has role drug metabolite (CHEBI:49103) 5-ethyl-5-methyl-1,3-oxazolidine-2,4-dione (CHEBI:179636) has role human blood serum metabolite (CHEBI:85234) 5-ethyl-5-methyl-1,3-oxazolidine-2,4-dione (CHEBI:179636) has role human xenobiotic metabolite (CHEBI:76967) 5-ethyl-5-methyl-1,3-oxazolidine-2,4-dione (CHEBI:179636) is a oxazolidinone (CHEBI:55374)

Incoming	paramethadione (CHEBI:7921) has functional parent 5-ethyl-5-methyl-1,3-oxazolidine-2,4-dione (CHEBI:179636)

IUPAC Name

5-ethyl-5-methyl-1,3-oxazolidine-2,4-dione

Synonyms	Sources
5-ethyl-5-methyl-2,4-oxazolidinedione	ChEBI
5-ethyl-5-methyloxazolidine-2,4-dione	ChEBI

Registry Number	Type	Source
52387-52-7	CAS Registry Number	NIST Chemistry WebBook

Last Modified

05 May 2023