EMBL-EBI | Chemical Biology | ChEBI
Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search
| Formula | C16H12N2O3 |
| Net Charge | 0 |
| Average Mass | 280.283 |
| Monoisotopic Mass | 280.08479 |
| SMILES | O=C(NCc1cccnc1)c1cc2ccccc2oc1=O |
| InChI | InChI=1S/C16H12N2O3/c19-15(18-10-11-4-3-7-17-9-11)13-8-12-5-1-2-6-14(12)21-16(13)20/h1-9H,10H2,(H,18,19) |
| InChIKey | GXRWFQXJMISBIT-UHFFFAOYSA-N |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| 2-oxo-N-(3-pyridinylmethyl)-1-benzopyran-3-carboxamide (CHEBI:94091) is a coumarins (CHEBI:23403) |
| Manual Xrefs | Databases |
|---|---|
| LSM-4697 | LINCS |