EMBL-EBI | Chemical Biology | ChEBI
Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search
| Formula | C4H6O5S |
| Net Charge | 0 |
| Average Mass | 166.154 |
| Monoisotopic Mass | 165.99359 |
| SMILES | O=C(O)CS(=O)CC(=O)O |
| InChI | InChI=1S/C4H6O5S/c5-3(6)1-10(9)2-4(7)8/h1-2H2,(H,5,6)(H,7,8) |
| InChIKey | AUKDKWLCVXCCBN-UHFFFAOYSA-N |
| Roles Classification |
|---|
| Chemical Role: | Bronsted acid A molecular entity capable of donating a hydron to an acceptor (Brønsted base). |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| thiodiacetic acid sulfoxide (CHEBI:35013) is a dicarboxylic acid (CHEBI:35692) |
| thiodiacetic acid sulfoxide (CHEBI:35013) is a sulfoxide (CHEBI:22063) |
| Synonym | Source |
|---|---|
| Thiodiacetic acid sulfoxide | KEGG COMPOUND |
| Manual Xrefs | Databases |
|---|---|
| C14873 | KEGG COMPOUND |
| Registry Numbers | Sources |
|---|---|
| CAS:33388-14-6 | KEGG COMPOUND |