EMBL-EBI | Chemical Biology | ChEBI
Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search
| Formula | C18H21N5O3 |
| Net Charge | 0 |
| Average Mass | 355.398 |
| Monoisotopic Mass | 355.16444 |
| SMILES | CCCCOc1ccc(-c2nnn(CC(=O)NCc3ccco3)n2)cc1 |
| InChI | InChI=1S/C18H21N5O3/c1-2-3-10-25-15-8-6-14(7-9-15)18-20-22-23(21-18)13-17(24)19-12-16-5-4-11-26-16/h4-9,11H,2-3,10,12-13H2,1H3,(H,19,24) |
| InChIKey | JUHBAVDRLGEFCZ-UHFFFAOYSA-N |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| 2-[5-(4-butoxyphenyl)-2-tetrazolyl]-N-(2-furanylmethyl)acetamide (CHEBI:123147) is a tetrazoles (CHEBI:35689) |
| Manual Xrefs | Databases |
|---|---|
| LSM-34589 | LINCS |