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CHEBI:86760 - lignin cw compound-2068

ChEBI IDCHEBI:86760
ChEBI Namelignin cw compound-2068
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FormulaC31H32O11
Net Charge0
Average Mass580.586
Monoisotopic Mass580.19446
SMILESCOc1ccccc1O[C@H](COC(=O)/C=C/c1ccc(OC(C)=O)cc1)[C@@H](O)c1cc(OC)c(OC(C)=O)c(OC)c1
InChIInChI=1S/C31H32O11/c1-19(32)40-23-13-10-21(11-14-23)12-15-29(34)39-18-28(42-25-9-7-6-8-24(25)36-3)30(35)22-16-26(37-4)31(41-20(2)33)27(17-22)38-5/h6-17,28,30,35H,18H2,1-5H3/b15-12+/t28-,30+/m1/s1
InChIKeyJBGFJCZYGRXPRT-SISFDJNFSA-N
ChEBI Ontology
Outgoing Relation(s)
lignin cw compound-2068 (CHEBI:86760) is a phenylpropanoid (CHEBI:26004)