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CHEBI:86714 - lignin cw compound-2018

ChEBI IDCHEBI:86714
ChEBI Namelignin cw compound-2018
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FormulaC20H18O8
Net Charge0
Average Mass386.356
Monoisotopic Mass386.10017
SMILESCOc1cc(C2Oc3c(OC)cc(/C=C/C(=O)O)cc3C2C(=O)O)ccc1O
InChIInChI=1S/C20H18O8/c1-26-14-9-11(4-5-13(14)21)18-17(20(24)25)12-7-10(3-6-16(22)23)8-15(27-2)19(12)28-18/h3-9,17-18,21H,1-2H3,(H,22,23)(H,24,25)/b6-3+
InChIKeyJTHPLBUVRLOJBB-ZZXKWVIFSA-N
ChEBI Ontology
Outgoing Relation(s)
lignin cw compound-2018 (CHEBI:86714) is a benzofurans (CHEBI:35259)