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CHEBI:178685 - 7-Methyl-1,4,5-naphthalenetriol 4-[xylosyl-(1->6)-glucoside]

ChEBI IDCHEBI:178685
ChEBI Name7-Methyl-1,4,5-naphthalenetriol 4-[xylosyl-(1->6)-glucoside]
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SubmitterMetaboLights
DownloadsMolfile
FormulaC22H28O12
Net Charge0
Average Mass484.454
Monoisotopic Mass484.15808
SMILESCc1cc(O)c2c(OC3OC(COC4OCC(O)C(O)C4O)C(O)C(O)C3O)ccc(O)c2c1
InChIInChI=1S/C22H28O12/c1-8-4-9-10(23)2-3-13(15(9)11(24)5-8)33-22-20(30)18(28)17(27)14(34-22)7-32-21-19(29)16(26)12(25)6-31-21/h2-5,12,14,16-30H,6-7H2,1H3
InChIKeyHONDCAIBTDBEKM-UHFFFAOYSA-N
ChEBI Ontology
Outgoing Relation(s)
7-Methyl-1,4,5-naphthalenetriol 4-[xylosyl-(1->6)-glucoside] (CHEBI:178685) is a glycoside (CHEBI:24400)
IUPAC Name 
2-(4,8-dihydroxy-6-methylnaphthalen-1-yl)oxy-6-[(3,4,5-trihydroxyoxan-2-yl)oxymethyl]oxane-3,4,5-triol
Manual XrefsDatabases
HMDB0034909HMDB