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CHEBI:176082 - w-O-beta-D-Glucopyranosylaloeemodin

ChEBI IDCHEBI:176082
ChEBI Namew-O-beta-D-Glucopyranosylaloeemodin
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FormulaC21H20O10
Net Charge0
Average Mass432.381
Monoisotopic Mass432.10565
SMILESO=C1c2cccc(O)c2C(=O)c2c(O)cc(COC3OC(CO)C(O)C(O)C3O)cc21
InChIInChI=1S/C21H20O10/c22-6-13-17(26)19(28)20(29)21(31-13)30-7-8-4-10-15(12(24)5-8)18(27)14-9(16(10)25)2-1-3-11(14)23/h1-5,13,17,19-24,26,28-29H,6-7H2
InChIKeyASQHVCDULHERIH-UHFFFAOYSA-N
ChEBI Ontology
Outgoing Relation(s)
w-O-beta-D-Glucopyranosylaloeemodin (CHEBI:176082) is a anthraquinone (CHEBI:22580)
IUPAC Name 
1,8-dihydroxy-3-[[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxymethyl]anthracene-9,10-dione
Manual XrefsDatabases
HMDB0034405HMDB
26503152ChemSpider