EMBL-EBI | Chemical Biology | ChEBI
Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search
| Formula | C18H17BrN2O3 |
| Net Charge | 0 |
| Average Mass | 389.249 |
| Monoisotopic Mass | 388.04225 |
| SMILES | Cc1cc2cc(CCNC(=O)c3ccc(Br)o3)c(=O)nc2cc1C |
| InChI | InChI=1S/C18H17BrN2O3/c1-10-7-13-9-12(17(22)21-14(13)8-11(10)2)5-6-20-18(23)15-3-4-16(19)24-15/h3-4,7-9H,5-6H2,1-2H3,(H,20,23)(H,21,22) |
| InChIKey | RQMUJRQFJXFLLI-UHFFFAOYSA-N |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| 5-bromo-N-[2-(6,7-dimethyl-2-oxo-1H-quinolin-3-yl)ethyl]-2-furancarboxamide (CHEBI:109407) is a quinolines (CHEBI:26513) |
| Manual Xrefs | Databases |
|---|---|
| LSM-20805 | LINCS |