EMBL-EBI | Chemical Biology | ChEBI
Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search
| Formula | C17H14ClN3O3 |
| Net Charge | 0 |
| Average Mass | 343.770 |
| Monoisotopic Mass | 343.07237 |
| SMILES | O=C(c1ccc2nc3ccc(Cl)cc3c(=O)n2c1)N1CCOCC1 |
| InChI | InChI=1S/C17H14ClN3O3/c18-12-2-3-14-13(9-12)17(23)21-10-11(1-4-15(21)19-14)16(22)20-5-7-24-8-6-20/h1-4,9-10H,5-8H2 |
| InChIKey | VIURMXCKGJBPOY-UHFFFAOYSA-N |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| 2-chloro-8-[4-morpholinyl(oxo)methyl]-11-pyrido[2,1-b]quinazolinone (CHEBI:115590) is a pyridopyrimidine (CHEBI:38932) |
| Manual Xrefs | Databases |
|---|---|
| LSM-27047 | LINCS |