CHEBI:89053 - 2,3-Octanedione

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ChEBI Name 2,3-Octanedione ChEBI ID CHEBI:89053 Stars This entity has been manually annotated by a third party. Supplier Information Download Molfile XML SDF Find compounds which contain this structure Find compounds which resemble this structure Take structure to the Advanced Search Formula C8H14O2 Net Charge 0 Average Mass 142.196 Monoisotopic Mass 142.09938 InChI InChI=1S/C8H14O2/c1-3-4-5-6-8(10)7(2)9/h3-6H2,1-2H3 InChIKey XCBBNTFYSLADTO-UHFFFAOYSA-N SMILES CCCCCC(C(C)=O)=O Metabolite of Species Details Homo sapiens (NCBI:txid9606) Found in saliva (UBERON:0001836). See: PubMed ChEBI Ontology Outgoing 2,3-Octanedione (CHEBI:89053) is a α-diketone (CHEBI:51869) Synonyms Sources 2,3-Dioxooctane HMDB 2,3-Octadione HMDB 2,3-Octandione HMDB Methyl pentyl diketone HMDB Octane-2,3-dione HMDB octane-2,3-dione HMDB Manual Xref Database HMDB0031293 HMDB View more database links Registry Number Type Source 585-25-1 CAS Registry Number KEGG COMPOUND Citation Type Source 24421258 PubMed citation Europe PMC