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CHEBI:213520 - Coniosclerodin

ChEBI IDCHEBI:213520
ChEBI NameConiosclerodin
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SubmitterMetaboLights
DownloadsMolfile
FormulaC18H16O6
Net Charge0
Average Mass328.320
Monoisotopic Mass328.09469
SMILESCC(C)=CCOc1cc(=O)c2c(O)oc(O)c3c(=O)cc(C)c1c32
InChIInChI=1S/C18H16O6/c1-8(2)4-5-23-12-7-11(20)15-16-13(12)9(3)6-10(19)14(16)17(21)24-18(15)22/h4,6-7,21-22H,5H2,1-3H3
InChIKeyYIWMIFMRTGJLEY-UHFFFAOYSA-N
Species of MetaboliteComponentSourceComments
Neosetophoma cerealis (ncbitaxon:2718965) - PubMed (21103541)
ChEBI Ontology
Outgoing Relation(s)
Coniosclerodin (CHEBI:213520) is a naphthalenes (CHEBI:25477)
IUPAC Name 
2,4-dihydroxy-8-methyl-10-(3-methylbut-2-enoxy)-3-oxatricyclo[7.3.1.05,13]trideca-1,4,7,9(13),10-pentaene-6,12-dione
Manual XrefsDatabases
78435972ChemSpider