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CHEBI:230810 - 6-demethylgriseofulvin

Default Structure
ChEBI IDCHEBI:230810
ChEBI Name6-demethylgriseofulvin
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC16H15ClO6
Net Charge0
Average Mass338.743
Monoisotopic Mass338.05572
SMILESCOC1=CC(=O)CC(C)C12Oc1c(Cl)c(O)cc(OC)c1C2=O
InChIInChI=1S/C16H15ClO6/c1-7-4-8(18)5-11(22-3)16(7)15(20)12-10(21-2)6-9(19)13(17)14(12)23-16/h5-7,19H,4H2,1-3H3
InChIKeySYNGDIBHUPXIQA-UHFFFAOYSA-N
Species of MetaboliteComponentSourceComments
Homo sapiens (ncbitaxon:9606) feces (BTO:0000440) MetaboLights (MTBLS9087)
ChEBI Ontology
Outgoing Relation(s)
6-demethylgriseofulvin (CHEBI:230810) is a organic molecular entity (CHEBI:50860)
IUPAC Name 
7-chloro-6-hydroxy-3',4-dimethoxy-5'-methylspiro[1-benzouran-2,4'-cyclohex-2-ene]-1',3-dione
Manual XrefsDatabases
141692ChemSpider
HMDB0041813HMDB