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CHEBI:86717 - lignin cw compound-2021

ChEBI IDCHEBI:86717
ChEBI Namelignin cw compound-2021
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FormulaC20H20O6
Net Charge0
Average Mass356.374
Monoisotopic Mass356.12599
SMILESCOc1cc(C2Oc3c(OC)cc(/C=C/C=O)cc3C2CO)ccc1O
InChIInChI=1S/C20H20O6/c1-24-17-10-13(5-6-16(17)23)19-15(11-22)14-8-12(4-3-7-21)9-18(25-2)20(14)26-19/h3-10,15,19,22-23H,11H2,1-2H3/b4-3+
InChIKeyGWCSSLSMGCFIFR-ONEGZZNKSA-N
ChEBI Ontology
Outgoing Relation(s)
lignin cw compound-2021 (CHEBI:86717) is a benzofurans (CHEBI:35259)