EMBL-EBI | Chemical Biology | ChEBI
Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search
| Formula | C7H9NO4S2 |
| Net Charge | 0 |
| Average Mass | 235.286 |
| Monoisotopic Mass | 234.99730 |
| SMILES | O=C(NCCS(=O)(=O)O)c1cccs1 |
| InChI | InChI=1S/C7H9NO4S2/c9-7(6-2-1-4-13-6)8-3-5-14(10,11)12/h1-2,4H,3,5H2,(H,8,9)(H,10,11,12) |
| InChIKey | JJXDGYJCYKWEAI-UHFFFAOYSA-N |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| taurosteine (CHEBI:134954) is a aromatic amide (CHEBI:62733) |
| taurosteine (CHEBI:134954) is a thiophenes (CHEBI:26961) |
| Manual Xrefs | Databases |
|---|---|
| 2569 | DrugCentral |
| Registry Numbers | Sources |
|---|---|
| CAS:124066-33-7 | DrugCentral |