EMBL-EBI | Chemical Biology | ChEBI
Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search
| Formula | C17H12N2O2 |
| Net Charge | 0 |
| Average Mass | 276.295 |
| Monoisotopic Mass | 276.08988 |
| SMILES | O=C1CN2C(=C1c1ccccc1)NC(=O)c1ccccc12 |
| InChI | InChI=1S/C17H12N2O2/c20-14-10-19-13-9-5-4-8-12(13)17(21)18-16(19)15(14)11-6-2-1-3-7-11/h1-9H,10H2,(H,18,21) |
| InChIKey | ABPHLWTZNRABDN-UHFFFAOYSA-N |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| 3-phenyl-1,4-dihydropyrrolo[1,2-a]quinazoline-2,5-dione (CHEBI:108111) is a pyrroline (CHEBI:23763) |
| Manual Xrefs | Databases |
|---|---|
| LSM-19488 | LINCS |