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CHEBI:86805 - lignin cw compound-282

ChEBI IDCHEBI:86805
ChEBI Namelignin cw compound-282
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FormulaC28H34O10
Net Charge0
Average Mass530.570
Monoisotopic Mass530.21520
SMILESCCC(OC(C)=O)c1cc(OC)c(OC(C)=O)c(-c2cc(C(CC)OC(C)=O)cc(OC)c2OC(C)=O)c1
InChIInChI=1S/C28H34O10/c1-9-23(35-15(3)29)19-11-21(27(37-17(5)31)25(13-19)33-7)22-12-20(24(10-2)36-16(4)30)14-26(34-8)28(22)38-18(6)32/h11-14,23-24H,9-10H2,1-8H3
InChIKeyABSSVVFAIPWUHX-UHFFFAOYSA-N
ChEBI Ontology
Outgoing Relation(s)
lignin cw compound-282 (CHEBI:86805) has functional parent tetracarboxylic acid (CHEBI:35742)
lignin cw compound-282 (CHEBI:86805) is a organooxygen compound (CHEBI:36963)