EMBL-EBI | Chemical Biology | ChEBI
Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search
| Formula | C17H13N5 |
| Net Charge | 0 |
| Average Mass | 287.326 |
| Monoisotopic Mass | 287.11710 |
| SMILES | Cc1ccc(-n2nnc(-c3cnc4ccccc4c3)n2)cc1 |
| InChI | InChI=1S/C17H13N5/c1-12-6-8-15(9-7-12)22-20-17(19-21-22)14-10-13-4-2-3-5-16(13)18-11-14/h2-11H,1H3 |
| InChIKey | SQNTWOJUKZHXKP-UHFFFAOYSA-N |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| 3-[2-(4-methylphenyl)-5-tetrazolyl]quinoline (CHEBI:121865) is a tetrazoles (CHEBI:35689) |
| Manual Xrefs | Databases |
|---|---|
| LSM-33308 | LINCS |