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CHEBI:86843 - lignin cw compound-3029

ChEBI IDCHEBI:86843
ChEBI Namelignin cw compound-3029
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FormulaC21H24O6
Net Charge0
Average Mass372.417
Monoisotopic Mass372.15729
SMILESCOc1cc(C(CCOC(C)=O)OC(C)=O)ccc1OCc1ccccc1
InChIInChI=1S/C21H24O6/c1-15(22)25-12-11-19(27-16(2)23)18-9-10-20(21(13-18)24-3)26-14-17-7-5-4-6-8-17/h4-10,13,19H,11-12,14H2,1-3H3
InChIKeyRHBXJTACOVUKGY-UHFFFAOYSA-N
ChEBI Ontology
Outgoing Relation(s)
lignin cw compound-3029 (CHEBI:86843) has functional parent benzyl alcohol (CHEBI:17987)
lignin cw compound-3029 (CHEBI:86843) is a carboxylic ester (CHEBI:33308)