EMBL-EBI | Chemical Biology | ChEBI
Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search
| Formula | C19H19FN2O4 |
| Net Charge | 0 |
| Average Mass | 358.369 |
| Monoisotopic Mass | 358.13289 |
| SMILES | COC(=O)[C@H]1[C@H](CO)[C@H]2Cn3c(ccc(-c4ccccc4F)c3=O)[C@@H]1N2 |
| InChI | InChI=1S/C19H19FN2O4/c1-26-19(25)16-12(9-23)14-8-22-15(17(16)21-14)7-6-11(18(22)24)10-4-2-3-5-13(10)20/h2-7,12,14,16-17,21,23H,8-9H2,1H3/t12-,14-,16+,17+/m1/s1 |
| InChIKey | NXPHSKBMFHKARG-IRWJRLHMSA-N |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| LSM-11608 (CHEBI:100231) is a phenylpyridine (CHEBI:38193) |
| Manual Xrefs | Databases |
|---|---|
| LSM-11608 | LINCS |