CHEBI:229371 - 3,5-Heptanedione, 4-ethyl-2,2,6,6-tetramethyl-

ChEBI IDCHEBI:229371
ChEBI Name3,5-Heptanedione, 4-ethyl-2,2,6,6-tetramethyl-
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC13H24O2
Net Charge0
Average Mass212.333
Monoisotopic Mass212.17763
SMILESCCC(C(=O)C(C)(C)C)C(=O)C(C)(C)C
InChIInChI=1S/C13H24O2/c1-8-9(10(14)12(2,3)4)11(15)13(5,6)7/h9H,8H2,1-7H3
InChIKeyJKEWQMMYIOHEBI-UHFFFAOYSA-N
Species of MetaboliteComponentSourceComments
Oryctolagus cuniculus (ncbitaxon:9986) longissimus thoracis (BTO:0001651) MetaboLights (MTBLS8958)
ChEBI Ontology
Outgoing Relation(s)
3,5-Heptanedione, 4-ethyl-2,2,6,6-tetramethyl- (CHEBI:229371) is a β-diketone (CHEBI:67265)
IUPAC Name 
4-ethyl-2,2,6,6-tetramethylheptane-3,5-dione
Manual XrefsDatabases
475330ChemSpider