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CHEBI:133663 - thymol sulfate(1−)
| Formula | C10H13O4S |
| Net Charge | -1 |
| Average Mass | 229.277 |
| Monoisotopic Mass | 229.05400 |
| SMILES | Cc1ccc(C(C)C)c(OS(=O)(=O)[O-])c1 |
| InChI | InChI=1S/C10H14O4S/c1-7(2)9-5-4-8(3)6-10(9)14-15(11,12)13/h4-7H,1-3H3,(H,11,12,13)/p-1 |
| InChIKey | NODSEPOUFZPJEQ-UHFFFAOYSA-M |
| Roles Classification |
|---|
| Biological Role: | human xenobiotic metabolite Any human metabolite produced by metabolism of a xenobiotic compound in humans. |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| thymol sulfate(1−) (CHEBI:133663) has functional parent thymol (CHEBI:27607) |
| thymol sulfate(1−) (CHEBI:133663) has role human xenobiotic metabolite (CHEBI:76967) |
| thymol sulfate(1−) (CHEBI:133663) is a phenyl sulfate oxoanion (CHEBI:140317) |
| thymol sulfate(1−) (CHEBI:133663) is conjugate base of thymol sulfate (CHEBI:82911) |
| Incoming Relation(s) |
| thymol sulfate (CHEBI:82911) is conjugate acid of thymol sulfate(1−) (CHEBI:133663) |
| IUPAC Name |
|---|
| 5-methyl-2-(propan-2-yl)phenyl sulfate |
| Synonym | Source |
|---|---|
| thymol sulfate | ChEBI |