EMBL-EBI | Chemical Biology | ChEBI
Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search
| Formula | C17H12O7 |
| Net Charge | 0 |
| Average Mass | 328.276 |
| Monoisotopic Mass | 328.05830 |
| SMILES | COc1cc(O)c2c(c1O)C(=O)c1ccc(O)c(C(C)=O)c1C2=O |
| InChI | InChI=1S/C17H12O7/c1-6(18)11-8(19)4-3-7-12(11)17(23)13-9(20)5-10(24-2)16(22)14(13)15(7)21/h3-5,19-20,22H,1-2H3 |
| InChIKey | KHIDSVRMJAZIPI-UHFFFAOYSA-N |
| Species of Metabolite | Component | Source | Comments |
|---|---|---|---|
| Fusariumspecies (ncbitaxon:29916) | - | PubMed (20013477) |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| 5-acetyl-2-methoxy-1,4,6-trihydroxy-anthraquinone (CHEBI:206880) is a hydroxyanthraquinones (CHEBI:37485) |
| IUPAC Name |
|---|
| 5-acetyl-1,4,6-trihydroxy-2-methoxyanthracene-9,10-dione |
| Manual Xrefs | Databases |
|---|---|
| 26949180 | ChemSpider |