EMBL-EBI | Chemical Biology | ChEBI
Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search
| Formula | C16H14O5 |
| Net Charge | 0 |
| Average Mass | 286.283 |
| Monoisotopic Mass | 286.08412 |
| SMILES | COc1ccccc1OC1(C)OC(=O)c2ccccc2O1 |
| InChI | InChI=1S/C16H14O5/c1-16(20-14-10-6-5-9-13(14)18-2)19-12-8-4-3-7-11(12)15(17)21-16/h3-10H,1-2H3 |
| InChIKey | PSVDIHULUCLEJE-UHFFFAOYSA-N |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| guaimesal (CHEBI:135184) is a benzodioxine (CHEBI:64096) |
| Manual Xrefs | Databases |
|---|---|
| 1337 | DrugCentral |
| Registry Numbers | Sources |
|---|---|
| CAS:81674-79-5 | DrugCentral |