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CHEBI:218135 - 5-(3-hydroxybutan-2-yl)-2,3-dimethoxycyclohexa-2,5-diene-1,4-dione

ChEBI IDCHEBI:218135
ChEBI Name5-(3-hydroxybutan-2-yl)-2,3-dimethoxycyclohexa-2,5-diene-1,4-dione
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC12H16O5
Net Charge0
Average Mass240.255
Monoisotopic Mass240.09977
SMILESCOC1=C(OC)C(=O)C(C(C)C(C)O)=CC1=O
InChIInChI=1S/C12H16O5/c1-6(7(2)13)8-5-9(14)11(16-3)12(17-4)10(8)15/h5-7,13H,1-4H3
InChIKeyJAQXBCCCRCNHFC-UHFFFAOYSA-N
Species of MetaboliteComponentSourceComments
Malbranchea (ncbitaxon:5040) - PubMed (14763557)
Roles Classification
Biological Roles:
Escherichia coli metabolite  Any bacterial metabolite produced during a metabolic reaction in Escherichia coli.
mouse metabolite  Any mammalian metabolite produced during a metabolic reaction in a mouse (Mus musculus).
ChEBI Ontology
Outgoing Relation(s)
5-(3-hydroxybutan-2-yl)-2,3-dimethoxycyclohexa-2,5-diene-1,4-dione (CHEBI:218135) is a ubiquinones (CHEBI:16389)
IUPAC Name 
5-(3-hydroxybutan-2-yl)-2,3-dimethoxycyclohexa-2,5-diene-1,4-dione
Manual XrefsDatabases
9451501ChemSpider