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CHEBI:86875 - lignin cw compound-3069

ChEBI IDCHEBI:86875
ChEBI Namelignin cw compound-3069
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FormulaC20H20O7
Net Charge0
Average Mass372.373
Monoisotopic Mass372.12090
SMILESCOc1cc(C2Oc3cc(/C=C/C=O)cc(OC)c3OC2CO)ccc1O
InChIInChI=1S/C20H20O7/c1-24-15-10-13(5-6-14(15)23)19-18(11-22)27-20-16(25-2)8-12(4-3-7-21)9-17(20)26-19/h3-10,18-19,22-23H,11H2,1-2H3/b4-3+
InChIKeyPNWVFJGJKJOSBG-ONEGZZNKSA-N
ChEBI Ontology
Outgoing Relation(s)
lignin cw compound-3069 (CHEBI:86875) is a benzodioxine (CHEBI:64096)