EMBL-EBI | Chemical Biology | ChEBI
Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search
| Formula | C16H13N5O |
| Net Charge | 0 |
| Average Mass | 291.314 |
| Monoisotopic Mass | 291.11201 |
| SMILES | COc1ccc(-c2ccnc3nc(-n4cccc4)nn23)cc1 |
| InChI | InChI=1S/C16H13N5O/c1-22-13-6-4-12(5-7-13)14-8-9-17-15-18-16(19-21(14)15)20-10-2-3-11-20/h2-11H,1H3 |
| InChIKey | CIVZTKAQLNKZRZ-UHFFFAOYSA-N |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| 7-(4-methoxyphenyl)-2-(1-pyrrolyl)-[1,2,4]triazolo[1,5-a]pyrimidine (CHEBI:105219) is a pyrimidines (CHEBI:39447) |
| Manual Xrefs | Databases |
|---|---|
| LSM-16582 | LINCS |