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CHEBI:199349 - Pleosporallin E

ChEBI IDCHEBI:199349
ChEBI NamePleosporallin E
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SubmitterMetaboLights
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FormulaC18H20O5
Net Charge0
Average Mass316.353
Monoisotopic Mass316.13107
SMILESCOc1c(C)c(O)cc(C)c1CC1=C(C)C(=O)C(=O)C(C)=C1O
InChIInChI=1S/C18H20O5/c1-8-6-14(19)10(3)18(23-5)12(8)7-13-9(2)16(21)17(22)11(4)15(13)20/h6,19-20H,7H2,1-5H3
InChIKeyADUKPOMPYNADQF-UHFFFAOYSA-N
ChEBI Ontology
Outgoing Relation(s)
Pleosporallin E (CHEBI:199349) is a methoxybenzenes (CHEBI:51683)
Pleosporallin E (CHEBI:199349) is a phenols (CHEBI:33853)
IUPAC Name 
4-hydroxy-5-[(4-hydroxy-2-methoxy-3,6-dimethylphenyl)methyl]-3,6-dimethylcyclohexa-3,5-diene-1,2-dione
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78435331ChemSpider