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CHEBI:93071 - 8,10-dichloro-3,9-dimethoxy-1,4,7-trimethyl-6-oxo-2-benzo[b][1,4]benzodioxepincarboxylic acid methyl ester

Default Structure
ChEBI IDCHEBI:93071
ChEBI Name8,10-dichloro-3,9-dimethoxy-1,4,7-trimethyl-6-oxo-2-benzo[b][1,4]benzodioxepincarboxylic acid methyl ester
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FormulaC20H18Cl2O7
Net Charge0
Average Mass441.263
Monoisotopic Mass440.04296
SMILESCOC(=O)c1c(C)c2c(c(C)c1OC)OC(=O)c1c(C)c(Cl)c(OC)c(Cl)c1O2
InChIInChI=1S/C20H18Cl2O7/c1-7-10-17(13(22)18(26-5)12(7)21)28-15-8(2)11(19(23)27-6)14(25-4)9(3)16(15)29-20(10)24/h1-6H3
InChIKeyPDTLWAZKMKQSLD-UHFFFAOYSA-N
ChEBI Ontology
Outgoing Relation(s)
8,10-dichloro-3,9-dimethoxy-1,4,7-trimethyl-6-oxo-2-benzo[b][1,4]benzodioxepincarboxylic acid methyl ester (CHEBI:93071) is a carbonyl compound (CHEBI:36586)
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