EMBL-EBI | Chemical Biology | ChEBI
Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search
| Formula | C21H22O10 |
| Net Charge | 0 |
| Average Mass | 434.397 |
| Monoisotopic Mass | 434.12130 |
| SMILES | O=C(CCc1ccccc1O)c1cc(O)ccc1OC1OC(C(=O)O)C(O)C(O)C1O |
| InChI | InChI=1S/C21H22O10/c22-11-6-8-15(30-21-18(27)16(25)17(26)19(31-21)20(28)29)12(9-11)14(24)7-5-10-3-1-2-4-13(10)23/h1-4,6,8-9,16-19,21-23,25-27H,5,7H2,(H,28,29) |
| InChIKey | ILDJHNMISBFHHG-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-hydroxy-2-[3-(2-hydroxyphenyl)propanoyl]phenoxy}oxane-2-carboxylic acid (CHEBI:188384) is a flavonoids (CHEBI:72544) |
| 3,4,5-trihydroxy-6-{4-hydroxy-2-[3-(2-hydroxyphenyl)propanoyl]phenoxy}oxane-2-carboxylic acid (CHEBI:188384) is a glycoside (CHEBI:24400) |
| IUPAC Name |
|---|
| 3,4,5-trihydroxy-6-[4-hydroxy-2-[3-(2-hydroxyphenyl)propanoyl]phenoxy]oxane-2-carboxylic acid |
| Manual Xrefs | Databases |
|---|---|
| HMDB0135380 | HMDB |