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CHEBI:183430 - 5-acetyl-2,6-dimethyl-1,2,3,4-tetrahydropyridin-4-one

ChEBI IDCHEBI:183430
ChEBI Name5-acetyl-2,6-dimethyl-1,2,3,4-tetrahydropyridin-4-one
Stars
DefinitionA tetrahydropyridine that is 1,2,3,4-tetrahydropyridine substituted by methyl, oxo, acetyl and methyl groups at position 2, 4, 5, and 6, respectively.
Last Modified5 May 2023
SubmitterMetaboLights
DownloadsMolfile
FormulaC9H13NO2
Net Charge0
Average Mass167.208
Monoisotopic Mass167.09463
SMILESCC(=O)C1=C(C)NC(C)CC1=O
InChIInChI=1S/C9H13NO2/c1-5-4-8(12)9(7(3)11)6(2)10-5/h5,10H,4H2,1-3H3
InChIKeyZVVZLQBYQRVNQJ-UHFFFAOYSA-N
Species of MetaboliteComponentSourceComments
Bombus terrestris (ncbitaxon:30195)
hindgut (BTO:0000510) MetaboLights (MTBLS3637)
brain (BTO:0000142) MetaboLights (MTBLS3637)
hemolymph (BTO:0000572) MetaboLights (MTBLS3637)
ChEBI Ontology
Outgoing Relation(s)
5-acetyl-2,6-dimethyl-1,2,3,4-tetrahydropyridin-4-one (CHEBI:183430) is a 4-pyridones (CHEBI:20485)
5-acetyl-2,6-dimethyl-1,2,3,4-tetrahydropyridin-4-one (CHEBI:183430) is a methyl ketone (CHEBI:51867)
5-acetyl-2,6-dimethyl-1,2,3,4-tetrahydropyridin-4-one (CHEBI:183430) is a methylpyridines (CHEBI:25340)
5-acetyl-2,6-dimethyl-1,2,3,4-tetrahydropyridin-4-one (CHEBI:183430) is a tetrahydropyridine (CHEBI:26921)
5-acetyl-2,6-dimethyl-1,2,3,4-tetrahydropyridin-4-one (CHEBI:183430) is tautomer of 1-(4-hydroxy-2,6-dimethyl-5,6-dihydropyridin-3-yl)ethanone (CHEBI:181997)
Incoming Relation(s)
1-(4-hydroxy-2,6-dimethyl-5,6-dihydropyridin-3-yl)ethanone (CHEBI:181997) is tautomer of 5-acetyl-2,6-dimethyl-1,2,3,4-tetrahydropyridin-4-one (CHEBI:183430)
IUPAC Name 
5-acetyl-2,6-dimethyl-2,3-dihydropyridin-4(1H)-one
Synonyms  Source
5-acetyl-2,6-dimethyl-2,3-dihydro-1H-pyridin-4-oneChEBI
5-acetyl-2,6-dimethyl-2,3-dihydro-4(1H)-pyridinoneChEBI
Manual XrefsDatabases
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