EMBL-EBI | Chemical Biology | ChEBI
Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search
| Formula | C13H13NO4 |
| Net Charge | 0 |
| Average Mass | 247.250 |
| Monoisotopic Mass | 247.08446 |
| SMILES | CCn1cc(C(=O)O)c(=O)c2cc(OC)ccc21 |
| InChI | InChI=1S/C13H13NO4/c1-3-14-7-10(13(16)17)12(15)9-6-8(18-2)4-5-11(9)14/h4-7H,3H2,1-2H3,(H,16,17) |
| InChIKey | YTWMJESCVWECIP-UHFFFAOYSA-N |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| 1-ethyl-6-methoxy-4-oxo-3-quinolinecarboxylic acid (CHEBI:123322) is a quinolines (CHEBI:26513) |
| Manual Xrefs | Databases |
|---|---|
| LSM-34765 | LINCS |