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CHEBI:86772 - lignin cw compound-2082

ChEBI IDCHEBI:86772
ChEBI Namelignin cw compound-2082
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FormulaC21H24O9
Net Charge0
Average Mass420.414
Monoisotopic Mass420.14203
SMILESCOc1cc(C(=O)C(CO)Oc2c(OC)cccc2OC)cc(OC)c1OC(C)=O
InChIInChI=1S/C21H24O9/c1-12(23)29-21-16(27-4)9-13(10-17(21)28-5)19(24)18(11-22)30-20-14(25-2)7-6-8-15(20)26-3/h6-10,18,22H,11H2,1-5H3
InChIKeyDATHBCFUBBBJIJ-UHFFFAOYSA-N
ChEBI Ontology
Outgoing Relation(s)
lignin cw compound-2082 (CHEBI:86772) is a aromatic ketone (CHEBI:76224)