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CHEBI:86750 - lignin cw compound-2057

ChEBI IDCHEBI:86750
ChEBI Namelignin cw compound-2057
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FormulaC24H26O8
Net Charge0
Average Mass442.464
Monoisotopic Mass442.16277
SMILESCCOC(=O)/C=C/c1cc(OC)c(O)c(-c2cc(/C=C/C(=O)OCC)cc(OC)c2O)c1
InChIInChI=1S/C24H26O8/c1-5-31-21(25)9-7-15-11-17(23(27)19(13-15)29-3)18-12-16(8-10-22(26)32-6-2)14-20(30-4)24(18)28/h7-14,27-28H,5-6H2,1-4H3/b9-7+,10-8+
InChIKeyRYSUUJQKMDQXQI-FIFLTTCUSA-N
ChEBI Ontology
Outgoing Relation(s)
lignin cw compound-2057 (CHEBI:86750) is a biphenyls (CHEBI:22888)