EMBL-EBI | Chemical Biology | ChEBI
Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search
| Formula | C16H12N6O |
| Net Charge | 0 |
| Average Mass | 304.313 |
| Monoisotopic Mass | 304.10726 |
| SMILES | c1ccc(-n2nnnc2Oc2ccc(-n3ccnc3)cc2)cc1 |
| InChI | InChI=1S/C16H12N6O/c1-2-4-14(5-3-1)22-16(18-19-20-22)23-15-8-6-13(7-9-15)21-11-10-17-12-21/h1-12H |
| InChIKey | CBVWHRCGFLHGCV-UHFFFAOYSA-N |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| 5-[4-(1-imidazolyl)phenoxy]-1-phenyltetrazole (CHEBI:105906) is a tetrazoles (CHEBI:35689) |
| Manual Xrefs | Databases |
|---|---|
| LSM-17267 | LINCS |