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CHEBI:198349 - Malbranicin

ChEBI IDCHEBI:198349
ChEBI NameMalbranicin
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC11H12O4
Net Charge0
Average Mass208.213
Monoisotopic Mass208.07356
SMILESCOC1=CC(=O)C=C([C@@H](C)C(C)=O)C1=O
InChIInChI=1S/C11H12O4/c1-6(7(2)12)9-4-8(13)5-10(15-3)11(9)14/h4-6H,1-3H3/t6-/m0/s1
InChIKeyRYIGSNBSBGKNIH-LURJTMIESA-N
Species of MetaboliteComponentSourceComments
Malbranchea (ncbitaxon:5040) - PubMed (8294239)
ChEBI Ontology
Outgoing Relation(s)
Malbranicin (CHEBI:198349) is a p-quinones (CHEBI:25830)
Malbranicin (CHEBI:198349) is a benzoquinones (CHEBI:22729)
IUPAC Name 
2-methoxy-6-(3-oxobutan-2-yl)cyclohexa-2,5-diene-1,4-dione
Manual XrefsDatabases
2291528ChemSpider