EMBL-EBI | Chemical Biology | ChEBI
Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search
| Formula | C21H21N5 |
| Net Charge | 0 |
| Average Mass | 343.434 |
| Monoisotopic Mass | 343.17970 |
| SMILES | Cc1cccc(-c2nc(C(C)(C)C)nc2-c2ccc3nccnc3c2)n1 |
| InChI | InChI=1S/C21H21N5/c1-13-6-5-7-16(24-13)19-18(25-20(26-19)21(2,3)4)14-8-9-15-17(12-14)23-11-10-22-15/h5-12H,1-4H3,(H,25,26) |
| InChIKey | DKPQHFZUICCZHF-UHFFFAOYSA-N |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| 6-[2-tert-butyl-5-(6-methyl-2-pyridinyl)-1H-imidazol-4-yl]quinoxaline (CHEBI:91391) is a quinoxaline derivative (CHEBI:38771) |
| Manual Xrefs | Databases |
|---|---|
| LSM-1121 | LINCS |