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CHEBI:176379 - {4-[1-oxo-1-(2,4,6-trihydroxyphenyl)propan-2-yl]phenyl}oxidanesulfonic acid
| Formula | C15H14O8S |
| Net Charge | 0 |
| Average Mass | 354.336 |
| Monoisotopic Mass | 354.04094 |
| SMILES | CC(C(=O)c1c(O)cc(O)cc1O)c1ccc(OS(=O)(=O)O)cc1 |
| InChI | InChI=1S/C15H14O8S/c1-8(9-2-4-11(5-3-9)23-24(20,21)22)15(19)14-12(17)6-10(16)7-13(14)18/h2-8,16-18H,1H3,(H,20,21,22) |
| InChIKey | QVJWMXFISOIERI-UHFFFAOYSA-N |
| Species of Metabolite | Component | Source | Comments |
|---|---|---|---|
| Mus musculus (ncbitaxon:10090) | blood plasma (BTO:0000131) | MetaboLights (MTBLS2782) | Strain: ICR Mouse [NCIT:C37408] |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| {4-[1-oxo-1-(2,4,6-trihydroxyphenyl)propan-2-yl]phenyl}oxidanesulfonic acid (CHEBI:176379) is a ketone (CHEBI:17087) |
| IUPAC Name |
|---|
| [4-[1-oxo-1-(2,4,6-trihydroxyphenyl)propan-2-yl]phenyl] hydrogen sulate |
| Manual Xrefs | Databases |
|---|---|
| 74852706 | ChemSpider |
| HMDB0129986 | HMDB |