EMBL-EBI | Chemical Biology | ChEBI
Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search
| Formula | C21H24N2O4 |
| Net Charge | 0 |
| Average Mass | 368.433 |
| Monoisotopic Mass | 368.17361 |
| SMILES | COc1cc(C2C(C#N)=C(C)N=C3CC(C)(C)CC(=O)C32)cc(OC)c1O |
| InChI | InChI=1S/C21H24N2O4/c1-11-13(10-22)18(12-6-16(26-4)20(25)17(7-12)27-5)19-14(23-11)8-21(2,3)9-15(19)24/h6-7,18-19,25H,8-9H2,1-5H3 |
| InChIKey | YRBBPAJMHDUQCY-UHFFFAOYSA-N |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| LSM-16561 (CHEBI:105198) is a quinolines (CHEBI:26513) |
| Manual Xrefs | Databases |
|---|---|
| LSM-16561 | LINCS |