EMBL-EBI | Chemical Biology | ChEBI
Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search
| Formula | C11H12O3 |
| Net Charge | 0 |
| Average Mass | 192.214 |
| Monoisotopic Mass | 192.07864 |
| SMILES | COc1ccc2c(c1OC)CCC2=O |
| InChI | InChI=1S/C11H12O3/c1-13-10-6-4-7-8(11(10)14-2)3-5-9(7)12/h4,6H,3,5H2,1-2H3 |
| InChIKey | XQODIRIVQXQUFN-UHFFFAOYSA-N |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| 4,5-dimethoxy-2,3-dihydroinden-1-one (CHEBI:113112) is a indanones (CHEBI:24789) |
| Manual Xrefs | Databases |
|---|---|
| LSM-24522 | LINCS |