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CHEBI:86662 - lignin cw compound-100

ChEBI IDCHEBI:86662
ChEBI Namelignin cw compound-100
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FormulaC27H32O11
Net Charge0
Average Mass532.542
Monoisotopic Mass532.19446
SMILESCOc1cc(C(OC(C)=O)C(COC(C)=O)Oc2ccc(C(C)OC(C)=O)cc2)cc(OC)c1OC(C)=O
InChIInChI=1S/C27H32O11/c1-15(35-17(3)29)20-8-10-22(11-9-20)38-25(14-34-16(2)28)26(36-18(4)30)21-12-23(32-6)27(37-19(5)31)24(13-21)33-7/h8-13,15,25-26H,14H2,1-7H3
InChIKeyJOUUMQRHSWWUHM-UHFFFAOYSA-N
ChEBI Ontology
Outgoing Relation(s)
lignin cw compound-100 (CHEBI:86662) has functional parent tetracarboxylic acid (CHEBI:35742)
lignin cw compound-100 (CHEBI:86662) is a organooxygen compound (CHEBI:36963)