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CHEBI:27942 - 3-sulfomuconic acid
| Formula | C6H6O7S |
| Net Charge | 0 |
| Average Mass | 222.174 |
| Monoisotopic Mass | 221.98342 |
| SMILES | O=C(O)/C=C\C(=C/C(=O)O)S(=O)(=O)O |
| InChI | InChI=1S/C6H6O7S/c7-5(8)2-1-4(3-6(9)10)14(11,12)13/h1-3H,(H,7,8)(H,9,10)(H,11,12,13)/b2-1-,4-3+ |
| InChIKey | WEJLTUKIYDTEKT-BXTBVDPRSA-N |
| Species of Metabolite | Component | Source | Comments |
|---|---|---|---|
| Mus musculus (ncbitaxon:10090) | - | PubMed (19425150) | Source: BioModels - MODEL1507180067 |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| 3-sulfomuconic acid (CHEBI:27942) has functional parent muconic acid (CHEBI:38407) |
| 3-sulfomuconic acid (CHEBI:27942) is a carboxyalkanesulfonic acid (CHEBI:38031) |
| Synonyms | Source |
|---|---|
| 3-Sulfomuconate | KEGG COMPOUND |
| 3-sulfomuconate | ChEBI |