EMBL-EBI | Chemical Biology | ChEBI
Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search
| Formula | C26H26N6O2 |
| Net Charge | 0 |
| Average Mass | 454.534 |
| Monoisotopic Mass | 454.21172 |
| SMILES | CCc1ccc2nc(=O)c(CN(Cc3ccccc3)Cc3nnnn3Cc3ccco3)cc2c1 |
| InChI | InChI=1S/C26H26N6O2/c1-2-19-10-11-24-21(13-19)14-22(26(33)27-24)16-31(15-20-7-4-3-5-8-20)18-25-28-29-30-32(25)17-23-9-6-12-34-23/h3-14H,2,15-18H2,1H3,(H,27,33) |
| InChIKey | JINCUPVACKAPQS-UHFFFAOYSA-N |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| 6-ethyl-3-[[[1-(2-furanylmethyl)-5-tetrazolyl]methyl-(phenylmethyl)amino]methyl]-1H-quinolin-2-one (CHEBI:112859) is a quinolines (CHEBI:26513) |
| Manual Xrefs | Databases |
|---|---|
| LSM-24269 | LINCS |