EMBL-EBI | Chemical Biology | ChEBI
Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search
| Formula | C24H18BrN3O3 |
| Net Charge | 0 |
| Average Mass | 476.330 |
| Monoisotopic Mass | 475.05315 |
| SMILES | CC(=O)N1NC(=C2C(=O)N=c3ccc(Br)cc3=C2c2ccccc2)CC1c1ccco1 |
| InChI | InChI=1S/C24H18BrN3O3/c1-14(29)28-20(21-8-5-11-31-21)13-19(27-28)23-22(15-6-3-2-4-7-15)17-12-16(25)9-10-18(17)26-24(23)30/h2-12,20,27H,13H2,1H3 |
| InChIKey | LBCYQRCFAOESDK-UHFFFAOYSA-N |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| 3-[1-acetyl-5-(2-furanyl)-3-pyrazolidinylidene]-6-bromo-4-phenyl-2-quinolinone (CHEBI:113244) is a quinolines (CHEBI:26513) |
| Manual Xrefs | Databases |
|---|---|
| LSM-24655 | LINCS |