EMBL-EBI | Chemical Biology | ChEBI
Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search
CHEBI:137054 - 3-methoxy-4-hydroxyphenylethyleneglycol sulfate
| Formula | C9H12O7S |
| Net Charge | 0 |
| Average Mass | 264.255 |
| Monoisotopic Mass | 264.03037 |
| SMILES | COc1cc(C(O)CO)ccc1OS(=O)(=O)O |
| InChI | InChI=1S/C9H12O7S/c1-15-9-4-6(7(11)5-10)2-3-8(9)16-17(12,13)14/h2-4,7,10-11H,5H2,1H3,(H,12,13,14) |
| InChIKey | WUFPNASKMLJSND-UHFFFAOYSA-N |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| 3-methoxy-4-hydroxyphenylethyleneglycol sulfate (CHEBI:137054) is a aryl sulfate (CHEBI:37919) |
| Manual Xrefs | Databases |
|---|---|
| 4039 | ChemSpider |
| HMDB0000559 | HMDB |