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CHEBI:86889 - lignin cw compound-81

ChEBI IDCHEBI:86889
ChEBI Namelignin cw compound-81
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FormulaC22H24O9
Net Charge0
Average Mass432.425
Monoisotopic Mass432.14203
SMILESCOc1cc(C(C)=O)ccc1OC(CO)C(=O)c1cc(OC)c(OC(C)=O)c(OC)c1
InChIInChI=1S/C22H24O9/c1-12(24)14-6-7-16(17(8-14)27-3)31-20(11-23)21(26)15-9-18(28-4)22(30-13(2)25)19(10-15)29-5/h6-10,20,23H,11H2,1-5H3
InChIKeyXRQIQWQMUVHAKH-UHFFFAOYSA-N
ChEBI Ontology
Outgoing Relation(s)
lignin cw compound-81 (CHEBI:86889) is a aromatic ketone (CHEBI:76224)