EMBL-EBI | Chemical Biology | ChEBI
Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search
| Formula | C15H14O6 |
| Net Charge | 0 |
| Average Mass | 290.271 |
| Monoisotopic Mass | 290.07904 |
| SMILES | Oc1ccc([C@H]2Oc3c(ccc(O)c3O)C[C@@H]2O)cc1O |
| InChI | InChI=1S/C15H14O6/c16-9-3-1-7(5-11(9)18)14-12(19)6-8-2-4-10(17)13(20)15(8)21-14/h1-5,12,14,16-20H,6H2/t12-,14+/m0/s1 |
| InChIKey | TXULLYMENMRLHL-GXTWGEPZSA-N |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| Mesquitol (CHEBI:196279) is a hydroxyflavan (CHEBI:72010) |
| IUPAC Name |
|---|
| (2R,3S)-2-(3,4-dihydroxyphenyl)-3,4-dihydro-2H-chromene-3,7,8-triol |
| Manual Xrefs | Databases |
|---|---|
| 9208756 | ChemSpider |
| LMPK12020021 | LIPID MAPS |