EMBL-EBI | Chemical Biology | ChEBI
Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search
| Formula | C12H11NO4 |
| Net Charge | 0 |
| Average Mass | 233.223 |
| Monoisotopic Mass | 233.06881 |
| SMILES | COC1=C(C)C(=O)c2cc(=O)n(C)cc2C1=O |
| InChI | InChI=1S/C12H11NO4/c1-6-10(15)7-4-9(14)13(2)5-8(7)11(16)12(6)17-3/h4-5H,1-3H3 |
| InChIKey | BXQZTMMXFKFJIY-UHFFFAOYSA-N |
| Species of Metabolite | Component | Source | Comments |
|---|---|---|---|
| Streptomyces (ncbitaxon:1883) | - | PubMed (931809) |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| Mimosamycin (CHEBI:223332) is a isoquinolines (CHEBI:24922) |
| IUPAC Name |
|---|
| 7-methoxy-2,6-dimethylisoquinoline-3,5,8-trione |
| Manual Xrefs | Databases |
|---|---|
| 4053 | ChemSpider |