EMBL-EBI | Chemical Biology | ChEBI
Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search
| Formula | C22H22N4O2 |
| Net Charge | 0 |
| Average Mass | 374.444 |
| Monoisotopic Mass | 374.17428 |
| SMILES | CCn1nc(NC(=O)Cc2ccc(OC)cc2)c2cc3cc(C)ccc3nc21 |
| InChI | InChI=1S/C22H22N4O2/c1-4-26-22-18(13-16-11-14(2)5-10-19(16)23-22)21(25-26)24-20(27)12-15-6-8-17(28-3)9-7-15/h5-11,13H,4,12H2,1-3H3,(H,24,25,27) |
| InChIKey | GOECNYYIXGRBNW-UHFFFAOYSA-N |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| N-(1-ethyl-6-methyl-3-pyrazolo[3,4-b]quinolinyl)-2-(4-methoxyphenyl)acetamide (CHEBI:109269) is a quinolines (CHEBI:26513) |
| Manual Xrefs | Databases |
|---|---|
| LSM-20666 | LINCS |