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CHEBI:88405 - Homovanillic acid sulfate
| Formula | C9H10O7S |
| Net Charge | 0 |
| Average Mass | 262.239 |
| Monoisotopic Mass | 262.01472 |
| SMILES | COc1cc(CC(=O)O)ccc1OS(=O)(=O)O |
| InChI | InChI=1S/C9H10O7S/c1-15-8-4-6(5-9(10)11)2-3-7(8)16-17(12,13)14/h2-4H,5H2,1H3,(H,10,11)(H,12,13,14) |
| InChIKey | IACOAKYXFIWAQN-UHFFFAOYSA-N |
| Species of Metabolite | Component | Source | Comments |
|---|---|---|---|
| Homo sapiens (ncbitaxon:9606) | urine (BTO:0001419) | PubMed (22827565) |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| Homovanillic acid sulfate (CHEBI:88405) is a alcohol (CHEBI:30879) |
| Homovanillic acid sulfate (CHEBI:88405) is a phenols (CHEBI:33853) |
| Synonyms | Source |
|---|---|
| 2-[3-methoxy-4-(sulfooxy)phenyl]acetic acid | HMDB |
| 3-Methoxy-4-(sulfooxy)-benzeneacetic acid | HMDB |
| 4-Sulfooxy-3-methoxy-benzeneacetic acid | HMDB |
| 4-Sulfooxy-3-methoxyphenylacetic acid | HMDB |
| Manual Xrefs | Databases |
|---|---|
| HMDB0011719 | HMDB |
| Registry Numbers | Sources |
|---|---|
| CAS:38339-06-9 | KEGG COMPOUND |
| Citations |
|---|