EMBL-EBI | Chemical Biology | ChEBI
Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search
| Formula | C23H30N4O4S2 |
| Net Charge | 0 |
| Average Mass | 490.651 |
| Monoisotopic Mass | 490.17085 |
| SMILES | CC(C)(C)c1cnc(CSc2cnc(NC(=O)Cc3ccc(CNC(CO)CO)cc3)s2)o1 |
| InChI | InChI=1S/C23H30N4O4S2/c1-23(2,3)18-10-25-20(31-18)14-32-21-11-26-22(33-21)27-19(30)8-15-4-6-16(7-5-15)9-24-17(12-28)13-29/h4-7,10-11,17,24,28-29H,8-9,12-14H2,1-3H3,(H,26,27,30) |
| InChIKey | FDWQSLRDIBRKEI-UHFFFAOYSA-N |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| BMS-268770 (CHEBI:34550) is a acetamides (CHEBI:22160) |
| Synonym | Source |
|---|---|
| BMS-268770 | KEGG COMPOUND |
| Manual Xrefs | Databases |
|---|---|
| C14123 | KEGG COMPOUND |