EMBL-EBI | Chemical Biology | ChEBI
Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search
| Formula | C16H19Br3N2O |
| Net Charge | 0 |
| Average Mass | 495.053 |
| Monoisotopic Mass | 491.90475 |
| SMILES | Cc1cccc(NC(=O)C23CCC(C(Br)Br)(C2Br)C3(C)C)n1 |
| InChI | InChI=1S/C16H19Br3N2O/c1-9-5-4-6-10(20-9)21-13(22)16-8-7-15(11(16)17,12(18)19)14(16,2)3/h4-6,11-12H,7-8H2,1-3H3,(H,20,21,22) |
| InChIKey | SQFGIESILRVDDD-UHFFFAOYSA-N |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| 6-bromo-1-(dibromomethyl)-5,5-dimethyl-N-(6-methyl-2-pyridinyl)-4-bicyclo[2.1.1]hexanecarboxamide (CHEBI:112410) is a aromatic amide (CHEBI:62733) |
| Manual Xrefs | Databases |
|---|---|
| LSM-23822 | LINCS |