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CHEBI:188373 - 3,4,5-trihydroxy-6-{4-[3-oxo-3-(2,3,4,6-tetrahydroxyphenyl)propyl]phenoxy}oxane-2-carboxylic acid
| Formula | C21H22O12 |
| Net Charge | 0 |
| Average Mass | 466.395 |
| Monoisotopic Mass | 466.11113 |
| SMILES | O=C(CCc1ccc(OC2OC(C(=O)O)C(O)C(O)C2O)cc1)c1c(O)cc(O)c(O)c1O |
| InChI | InChI=1S/C21H22O12/c22-10(13-11(23)7-12(24)14(25)15(13)26)6-3-8-1-4-9(5-2-8)32-21-18(29)16(27)17(28)19(33-21)20(30)31/h1-2,4-5,7,16-19,21,23-29H,3,6H2,(H,30,31) |
| InChIKey | RXOUSSLDPXRDIG-UHFFFAOYSA-N |
| Species of Metabolite | Component | Source | Comments |
|---|---|---|---|
| Mus musculus (ncbitaxon:10090) | blood serum (BTO:0000133) | MetaboLights (MTBLS3886) |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| 3,4,5-trihydroxy-6-{4-[3-oxo-3-(2,3,4,6-tetrahydroxyphenyl)propyl]phenoxy}oxane-2-carboxylic acid (CHEBI:188373) is a flavonoids (CHEBI:72544) |
| 3,4,5-trihydroxy-6-{4-[3-oxo-3-(2,3,4,6-tetrahydroxyphenyl)propyl]phenoxy}oxane-2-carboxylic acid (CHEBI:188373) is a glycoside (CHEBI:24400) |
| IUPAC Name |
|---|
| 3,4,5-trihydroxy-6-[4-[3-oxo-3-(2,3,4,6-tetrahydroxyphenyl)propyl]phenoxy]oxane-2-carboxylic acid |
| Manual Xrefs | Databases |
|---|---|
| HMDB0130253 | HMDB |