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CHEBI:86710 - lignin cw compound-2011

Default Structure
ChEBI IDCHEBI:86710
ChEBI Namelignin cw compound-2011
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FormulaC28H32O11
Net Charge0
Average Mass544.553
Monoisotopic Mass544.19446
SMILESCOc1cc(C(OC(C)=O)C(COC(C)=O)Oc2ccc(/C=C/COC(C)=O)cc2OC)ccc1OC(C)=O
InChIInChI=1S/C28H32O11/c1-17(29)35-13-7-8-21-9-11-24(25(14-21)33-5)39-27(16-36-18(2)30)28(38-20(4)32)22-10-12-23(37-19(3)31)26(15-22)34-6/h7-12,14-15,27-28H,13,16H2,1-6H3/b8-7+
InChIKeyOKJDWXYZQZMQON-BQYQJAHWSA-N
ChEBI Ontology
Outgoing Relation(s)
lignin cw compound-2011 (CHEBI:86710) has functional parent tetracarboxylic acid (CHEBI:35742)
lignin cw compound-2011 (CHEBI:86710) is a organooxygen compound (CHEBI:36963)