EMBL-EBI | Chemical Biology | ChEBI
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| Formula | C21H20O10 |
| Net Charge | 0 |
| Average Mass | 432.381 |
| Monoisotopic Mass | 432.10565 |
| SMILES | Cc1cc(O)c2c(c1)C(=O)c1cc(O)cc(OC3OC(CO)C(O)C(O)C3O)c1C2=O |
| InChI | InChI=1S/C21H20O10/c1-7-2-9-14(11(24)3-7)18(27)15-10(16(9)25)4-8(23)5-12(15)30-21-20(29)19(28)17(26)13(6-22)31-21/h2-5,13,17,19-24,26,28-29H,6H2,1H3 |
| InChIKey | HSWIRQIYASIOBE-UHFFFAOYSA-N |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| Emodin 8-beta-D-glucoside (CHEBI:182887) is a hydroxyanthraquinones (CHEBI:37485) |
| IUPAC Name |
|---|
| 1,6-dihydroxy-3-methyl-8-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyanthracene-9,10-dione |
| Manual Xrefs | Databases |
|---|---|
| 282152 | ChemSpider |