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CHEBI:210885 - Penicillenone

ChEBI IDCHEBI:210885
ChEBI NamePenicillenone
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC16H16O6
Net Charge0
Average Mass304.298
Monoisotopic Mass304.09469
SMILESCOc1ccc(/C(O)=C2/C(=O)[C@](C)(O)C(=O)C=C2C)c(O)c1
InChIInChI=1S/C16H16O6/c1-8-6-12(18)16(2,21)15(20)13(8)14(19)10-5-4-9(22-3)7-11(10)17/h4-7,17,19,21H,1-3H3/b14-13-/t16-/m1/s1
InChIKeyXHDBNNITLMCRAU-OMACXJQVSA-N
Species of MetaboliteComponentSourceComments
Penicillium (ncbitaxon:5073) - PubMed (18067932)
ChEBI Ontology
Outgoing Relation(s)
Penicillenone (CHEBI:210885) is a methoxybenzenes (CHEBI:51683)
Penicillenone (CHEBI:210885) is a phenols (CHEBI:33853)
IUPAC Name 
(2R,6Z)-2-hydroxy-6-[hydroxy-(2-hydroxy-4-methoxyphenyl)methylidene]-2,5-dimethylcyclohex-4-ene-1,3-dione
Manual XrefsDatabases
27023667ChemSpider