CHEBI:28286 - cyclohexane-1,4-dione

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ChEBI Name cyclohexane-1,4-dione ChEBI ID CHEBI:28286 Definition A cyclohexanedione with oxo substituents at positions 1 and 4. Stars This entity has been manually annotated by the ChEBI Team. Secondary ChEBI IDs CHEBI:535, CHEBI:18929 Supplier Information Download Molfile XML SDF Find compounds which contain this structure Find compounds which resemble this structure Take structure to the Advanced Search Wikipedia License Read full article at Wikipedia Formula C6H8O2 Net Charge 0 Average Mass 112.12652 Monoisotopic Mass 112.05243 InChI InChI=1S/C6H8O2/c7-5-1-2-6(8)4-3-5/h1-4H2 InChIKey DCZFGQYXRKMVFG-UHFFFAOYSA-N SMILES O=C1CCC(=O)CC1 ChEBI Ontology Outgoing cyclohexane-1,4-dione (CHEBI:28286) is a cyclohexanedione (CHEBI:23478) Incoming levodione (CHEBI:86400) has functional parent cyclohexane-1,4-dione (CHEBI:28286) IUPAC Name cyclohexane-1,4-dione Synonyms Sources 1,4-Cyclohexanedione KEGG COMPOUND 1,4-dioxocyclohexane NIST Chemistry WebBook tetrahydroquinone NIST Chemistry WebBook Manual Xrefs Databases 1,4-Cyclohexanedione Wikipedia c0554 UM-BBD C08063 KEGG COMPOUND View more database links Registry Numbers Types Sources 101292 Gmelin Registry Number Gmelin 637-88-7 CAS Registry Number KEGG COMPOUND 637-88-7 CAS Registry Number ChemIDplus 637-88-7 CAS Registry Number NIST Chemistry WebBook 774152 Beilstein Registry Number Beilstein 774152 Reaxys Registry Number Reaxys Citation Type Source 16504460 PubMed citation Europe PMC Last Modified 16 July 2015