EMBL-EBI | Chemical Biology | ChEBI
Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search
| Formula | C16H12O5 |
| Net Charge | 0 |
| Average Mass | 284.267 |
| Monoisotopic Mass | 284.06847 |
| SMILES | COc1c2c(cc(O)c1-c1cc3ccccc3o1)OCO2 |
| InChI | InChI=1S/C16H12O5/c1-18-16-14(10(17)7-13-15(16)20-8-19-13)12-6-9-4-2-3-5-11(9)21-12/h2-7,17H,8H2,1H3 |
| InChIKey | ACHFSGOIKJNVJV-UHFFFAOYSA-N |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| 2-(6-Hydroxy-2-methoxy-3,4-methylenedioxyphenyl)benzofuran (CHEBI:174708) is a benzofurans (CHEBI:35259) |
| IUPAC Name |
|---|
| 6-(1-benzouran-2-yl)-7-methoxy-1,3-benzodioxol-5-ol |
| Manual Xrefs | Databases |
|---|---|
| 9066636 | ChemSpider |
| HMDB0030768 | HMDB |