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CHEBI:86779 - lignin cw compound-218

ChEBI IDCHEBI:86779
ChEBI Namelignin cw compound-218
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FormulaC22H26O8
Net Charge0
Average Mass418.442
Monoisotopic Mass418.16277
SMILESCOc1cc(CC(COC(C)=O)Oc2c(OC)cccc2OC)ccc1OC(C)=O
InChIInChI=1S/C22H26O8/c1-14(23)28-13-17(30-22-19(25-3)7-6-8-20(22)26-4)11-16-9-10-18(29-15(2)24)21(12-16)27-5/h6-10,12,17H,11,13H2,1-5H3
InChIKeyCQMVPHQFVOISKQ-UHFFFAOYSA-N
ChEBI Ontology
Outgoing Relation(s)
lignin cw compound-218 (CHEBI:86779) is a benzoate ester (CHEBI:36054)
lignin cw compound-218 (CHEBI:86779) is a phenols (CHEBI:33853)