EMBL-EBI | Chemical Biology | ChEBI
Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search
| Formula | C20H23N5O4 |
| Net Charge | 0 |
| Average Mass | 397.435 |
| Monoisotopic Mass | 397.17500 |
| SMILES | CCOc1ccc(-c2nnn(CC(=O)Nc3cccc(OC)c3)n2)cc1OCC |
| InChI | InChI=1S/C20H23N5O4/c1-4-28-17-10-9-14(11-18(17)29-5-2)20-22-24-25(23-20)13-19(26)21-15-7-6-8-16(12-15)27-3/h6-12H,4-5,13H2,1-3H3,(H,21,26) |
| InChIKey | QEVITPSZBNZUJS-UHFFFAOYSA-N |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| 2-[5-(3,4-diethoxyphenyl)-2-tetrazolyl]-N-(3-methoxyphenyl)acetamide (CHEBI:116724) is a tetrazoles (CHEBI:35689) |
| Manual Xrefs | Databases |
|---|---|
| LSM-28177 | LINCS |