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CHEBI:208300 - 6-Desmethyl-griseofulvin

Default Structure
ChEBI IDCHEBI:208300
ChEBI Name6-Desmethyl-griseofulvin
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC16H15ClO6
Net Charge0
Average Mass338.743
Monoisotopic Mass338.05572
SMILESCOC1=CC(=O)C[C@@H](C)[C@]12Oc1c(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/t7-,16+/m1/s1
InChIKeySYNGDIBHUPXIQA-QZTNRIJFSA-N
Species of MetaboliteComponentSourceComments
Penicillium raistrickii (ncbitaxon:69783) - PubMed (9748377)
ChEBI Ontology
Outgoing Relation(s)
6-Desmethyl-griseofulvin (CHEBI:208300) is a benzofurans (CHEBI:35259)
IUPAC Name 
(2S,5'R)-7-chloro-6-hydroxy-3',4-dimethoxy-5'-methylspiro[1-benzouran-2,4'-cyclohex-2-ene]-1',3-dione
Manual XrefsDatabases
8150009ChemSpider