EMBL-EBI | Chemical Biology | ChEBI
Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search
| Formula | C15H11NO3 |
| Net Charge | 0 |
| Average Mass | 253.257 |
| Monoisotopic Mass | 253.07389 |
| SMILES | O=C(O)c1cc2cc(Cc3cccnc3)ccc2o1 |
| InChI | InChI=1S/C15H11NO3/c17-15(18)14-8-12-7-10(3-4-13(12)19-14)6-11-2-1-5-16-9-11/h1-5,7-9H,6H2,(H,17,18) |
| InChIKey | VHWFITPGPFLBGT-UHFFFAOYSA-N |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| 5-(3-pyridinylmethyl)-2-benzofurancarboxylic acid (CHEBI:103833) is a benzofurans (CHEBI:35259) |
| Manual Xrefs | Databases |
|---|---|
| LSM-15180 | LINCS |