EMBL-EBI | Chemical Biology | ChEBI
Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search
| Formula | C19H22O7 |
| Net Charge | 0 |
| Average Mass | 362.378 |
| Monoisotopic Mass | 362.13655 |
| SMILES | COc1ccc2c(c1O)OC(c1cc(OC)c(OC)c(OC)c1O)CC2 |
| InChI | InChI=1S/C19H22O7/c1-22-13-8-6-10-5-7-12(26-17(10)16(13)21)11-9-14(23-2)18(24-3)19(25-4)15(11)20/h6,8-9,12,20-21H,5,7H2,1-4H3 |
| InChIKey | XVWADHIDSZCAFC-UHFFFAOYSA-N |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| 2',8-Dihydroxy-3',4',5',7-tetramethoxyflavan (CHEBI:175642) is a ether (CHEBI:25698) |
| 2',8-Dihydroxy-3',4',5',7-tetramethoxyflavan (CHEBI:175642) is a flavonoids (CHEBI:72544) |
| IUPAC Name |
|---|
| 2-(2-hydroxy-3,4,5-trimethoxyphenyl)-7-methoxy-3,4-dihydro-2H-chromen-8-ol |
| Manual Xrefs | Databases |
|---|---|
| HMDB0033905 | HMDB |
| 35013674 | ChemSpider |