EMBL-EBI | Chemical Biology | ChEBI
Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search
| Formula | C18H17NO4 |
| Net Charge | 0 |
| Average Mass | 311.337 |
| Monoisotopic Mass | 311.11576 |
| SMILES | COC(=O)c1cc2c(C)c(C)c3ccccn3c-2c1C(=O)OC |
| InChI | InChI=1S/C18H17NO4/c1-10-11(2)14-7-5-6-8-19(14)16-12(10)9-13(17(20)22-3)15(16)18(21)23-4/h5-9H,1-4H3 |
| InChIKey | WEBZFFLTBUZLOY-UHFFFAOYSA-N |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| 4,5-dimethylcyclopenta[c]quinolizine-1,2-dicarboxylic acid dimethyl ester (CHEBI:122153) is a quinolizines (CHEBI:38063) |
| Manual Xrefs | Databases |
|---|---|
| LSM-33596 | LINCS |