EMBL-EBI | Chemical Biology | ChEBI
Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search
| Formula | C20H22O2 |
| Net Charge | 0 |
| Average Mass | 294.394 |
| Monoisotopic Mass | 294.16198 |
| SMILES | COc1ccc(/C=C/CC/C=C/c2ccc(OC)cc2)cc1 |
| InChI | InChI=1S/C20H22O2/c1-21-19-13-9-17(10-14-19)7-5-3-4-6-8-18-11-15-20(22-2)16-12-18/h5-16H,3-4H2,1-2H3/b7-5+,8-6+ |
| InChIKey | FWOYMKXDIXNXIC-KQQUZDAGSA-N |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| (E,E)-1,6-bis(4-methoxyphenyl)-1,5-hexadiene (CHEBI:174113) is a methoxybenzenes (CHEBI:51683) |
| IUPAC Name |
|---|
| 1-methoxy-4-[(1E,5E)-6-(4-methoxyphenyl)hexa-1,5-dienyl]benzene |
| Manual Xrefs | Databases |
|---|---|
| 9316065 | ChemSpider |
| HMDB0035443 | HMDB |