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CHEBI:86727 - lignin cw compound-2033

ChEBI IDCHEBI:86727
ChEBI Namelignin cw compound-2033
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FormulaC20H18O8
Net Charge0
Average Mass386.356
Monoisotopic Mass386.10017
SMILESCOc1cc(/C=C2\C(=O)O[C@@H](c3ccc(O)c(OC)c3)[C@@H]2C(=O)O)ccc1O
InChIInChI=1S/C20H18O8/c1-26-15-8-10(3-5-13(15)21)7-12-17(19(23)24)18(28-20(12)25)11-4-6-14(22)16(9-11)27-2/h3-9,17-18,21-22H,1-2H3,(H,23,24)/b12-7-/t17-,18+/m1/s1
InChIKeyDPRATWBXIJCTDS-OUODJMRJSA-N
ChEBI Ontology
Outgoing Relation(s)
lignin cw compound-2033 (CHEBI:86727) is a methoxybenzenes (CHEBI:51683)
lignin cw compound-2033 (CHEBI:86727) is a phenols (CHEBI:33853)