EMBL-EBI | Chemical Biology | ChEBI
Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search
| Formula | C23H24N2O4S |
| Net Charge | 0 |
| Average Mass | 424.522 |
| Monoisotopic Mass | 424.14568 |
| SMILES | Cc1ccc(-n2c3c(cc(C(=O)NC4CCSC4=O)c2=O)C(=O)CC(C)(C)C3)cc1 |
| InChI | InChI=1S/C23H24N2O4S/c1-13-4-6-14(7-5-13)25-18-11-23(2,3)12-19(26)15(18)10-16(21(25)28)20(27)24-17-8-9-30-22(17)29/h4-7,10,17H,8-9,11-12H2,1-3H3,(H,24,27) |
| InChIKey | XFUCGEALYDLJRD-UHFFFAOYSA-N |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| 7,7-dimethyl-1-(4-methylphenyl)-2,5-dioxo-N-(2-oxo-3-thiolanyl)-6,8-dihydroquinoline-3-carboxamide (CHEBI:108424) is a quinolines (CHEBI:26513) |
| Manual Xrefs | Databases |
|---|---|
| LSM-19800 | LINCS |