EMBL-EBI | Chemical Biology | ChEBI
Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search
| Formula | C8H8O5S |
| Net Charge | 0 |
| Average Mass | 216.214 |
| Monoisotopic Mass | 216.00924 |
| SMILES | CC(=O)c1cccc(OS(=O)(=O)O)c1 |
| InChI | InChI=1S/C8H8O5S/c1-6(9)7-3-2-4-8(5-7)13-14(10,11)12/h2-5H,1H3,(H,10,11,12) |
| InChIKey | CGFRVKXGZRODPA-UHFFFAOYSA-N |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| 3-acetylphenol sulfate (CHEBI:232972) is a aromatic ketone (CHEBI:76224) |
| Manual Xrefs | Databases |
|---|---|
| HMDB0304930 | HMDB |