EMBL-EBI | Chemical Biology | ChEBI
Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search
| Formula | C9H10N4O2 |
| Net Charge | 0 |
| Average Mass | 206.205 |
| Monoisotopic Mass | 206.08038 |
| SMILES | COc1ccc(-c2nnnn2)cc1OC |
| InChI | InChI=1S/C9H10N4O2/c1-14-7-4-3-6(5-8(7)15-2)9-10-12-13-11-9/h3-5H,1-2H3,(H,10,11,12,13) |
| InChIKey | WMRZMZRQOCOXLD-UHFFFAOYSA-N |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| 5-(3,4-dimethoxyphenyl)-2H-tetrazole (CHEBI:115595) is a tetrazoles (CHEBI:35689) |
| Manual Xrefs | Databases |
|---|---|
| LSM-27052 | LINCS |