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CHEBI:86697 - lignin cw compound-168

ChEBI IDCHEBI:86697
ChEBI Namelignin cw compound-168
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FormulaC18H20O6
Net Charge0
Average Mass332.352
Monoisotopic Mass332.12599
SMILESCOc1ccc(C(O)C(CO)Oc2ccc(C=O)cc2)cc1OC
InChIInChI=1S/C18H20O6/c1-22-15-8-5-13(9-16(15)23-2)18(21)17(11-20)24-14-6-3-12(10-19)4-7-14/h3-10,17-18,20-21H,11H2,1-2H3
InChIKeyKDROCXKQEBZCRM-UHFFFAOYSA-N
ChEBI Ontology
Outgoing Relation(s)
lignin cw compound-168 (CHEBI:86697) is a phenylpropanoid (CHEBI:26004)