EMBL-EBI | Chemical Biology | ChEBI
Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search
| Formula | C13H13N5 |
| Net Charge | 0 |
| Average Mass | 239.282 |
| Monoisotopic Mass | 239.11710 |
| SMILES | Cc1ccc(C)n1-c1cccc(-c2nnnn2)c1 |
| InChI | InChI=1S/C13H13N5/c1-9-6-7-10(2)18(9)12-5-3-4-11(8-12)13-14-16-17-15-13/h3-8H,1-2H3,(H,14,15,16,17) |
| InChIKey | HGXBKEFXSPFLOP-UHFFFAOYSA-N |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| 5-[3-(2,5-dimethyl-1-pyrrolyl)phenyl]-2H-tetrazole (CHEBI:93378) is a tetrazoles (CHEBI:35689) |
| Manual Xrefs | Databases |
|---|---|
| LSM-3759 | LINCS |