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CHEBI:205199 - Coniothyrione

ChEBI IDCHEBI:205199
ChEBI NameConiothyrione
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SubmitterMetaboLights
DownloadsMolfile
FormulaC14H9ClO6
Net Charge0
Average Mass308.673
Monoisotopic Mass308.00877
SMILESCOC(=O)[C@]1(O)C(Cl)=Cc2oc3cccc(O)c3c(=O)c21
InChIInChI=1S/C14H9ClO6/c1-20-13(18)14(19)9(15)5-8-11(14)12(17)10-6(16)3-2-4-7(10)21-8/h2-5,16,19H,1H3/t14-/m0/s1
InChIKeyBRVCZJVNBKLHKH-AWEZNQCLSA-N
Species of MetaboliteComponentSourceComments
Coniothyrium (ncbitaxon:78388) - PubMed (17346074)
ChEBI Ontology
Outgoing Relation(s)
Coniothyrione (CHEBI:205199) is a chromones (CHEBI:23238)
IUPAC Name 
methyl 2-chloro-1,8-dihydroxy-9-oxocyclopenta[b]chromene-1-carboxylate
Manual XrefsDatabases
17344043ChemSpider