EMBL-EBI | Chemical Biology | ChEBI
Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search
| Formula | C10H10O4 |
| Net Charge | 0 |
| Average Mass | 194.186 |
| Monoisotopic Mass | 194.05791 |
| SMILES | COc1cc2c(cc1OC)C(=O)OC2 |
| InChI | InChI=1S/C10H10O4/c1-12-8-3-6-5-14-10(11)7(6)4-9(8)13-2/h3-4H,5H2,1-2H3 |
| InChIKey | UKFAWRZYFYOXEG-UHFFFAOYSA-N |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| 5,6-dimethoxy-3H-isobenzofuran-1-one (CHEBI:113547) is a 2-benzofurans (CHEBI:38831) |
| Manual Xrefs | Databases |
|---|---|
| LSM-24968 | LINCS |