EMBL-EBI | Chemical Biology | ChEBI
Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search
| Formula | C20H20O11 |
| Net Charge | 0 |
| Average Mass | 436.369 |
| Monoisotopic Mass | 436.10056 |
| SMILES | COC(=O)c1cc(O)cc(O)c1C(=O)c1c(O)cc(C)c(C(=O)OC[C@H](O)CO)c1O |
| InChI | InChI=1S/C20H20O11/c1-8-3-12(24)16(17(26)14(8)20(29)31-7-10(23)6-21)18(27)15-11(19(28)30-2)4-9(22)5-13(15)25/h3-5,10,21-26H,6-7H2,1-2H3/t10-/m1/s1 |
| InChIKey | WZYZAQUJHLHSOR-SNVBAGLBSA-N |
| Species of Metabolite | Component | Source | Comments |
|---|---|---|---|
| Aspergillus (ncbitaxon:5052) | - | PubMed (30193789) |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| Eurobenzophenone B (CHEBI:218190) is a benzophenones (CHEBI:22726) |
| IUPAC Name |
|---|
| [(2R)-2,3-dihydroxypropyl] 3-(2,4-dihydroxy-6-methoxycarbonylbenzoyl)-2,4-dihydroxy-6-methylbenzoate |
| Manual Xrefs | Databases |
|---|---|
| 71048725 | ChemSpider |