EMBL-EBI | Chemical Biology | ChEBI
Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search
| Formula | C16H12O7 |
| Net Charge | 0 |
| Average Mass | 316.265 |
| Monoisotopic Mass | 316.05830 |
| SMILES | COC(=O)c1cc(O)c(C(=O)c2c(O)cccc2C=O)c(O)c1 |
| InChI | InChI=1S/C16H12O7/c1-23-16(22)9-5-11(19)14(12(20)6-9)15(21)13-8(7-17)3-2-4-10(13)18/h2-7,18-20H,1H3 |
| InChIKey | ADZNQHXABBOWGA-UHFFFAOYSA-N |
| Species of Metabolite | Component | Source | Comments |
|---|---|---|---|
| Alternaria (ncbitaxon:5598) | - | DOI (10.1016/j.tetlet.2017.06.071) |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| Alternaphenol E (CHEBI:217663) is a benzophenones (CHEBI:22726) |
| IUPAC Name |
|---|
| methyl 4-(2-ormyl-6-hydroxybenzoyl)-3,5-dihydroxybenzoate |
| Manual Xrefs | Databases |
|---|---|
| 78435393 | ChemSpider |