EMBL-EBI | Chemical Biology | ChEBI
Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search
| Formula | C17H16O7 |
| Net Charge | 0 |
| Average Mass | 332.308 |
| Monoisotopic Mass | 332.08960 |
| SMILES | COC(=O)C1CC(=O)C=C(OC)C12Oc1cc(C)cc(O)c1C2=O |
| InChI | InChI=1S/C17H16O7/c1-8-4-11(19)14-12(5-8)24-17(15(14)20)10(16(21)23-3)6-9(18)7-13(17)22-2/h4-5,7,10,19H,6H2,1-3H3 |
| InChIKey | PFEHFUJOCNGJHU-UHFFFAOYSA-N |
| Species of Metabolite | Component | Source | Comments |
|---|---|---|---|
| Chrysosporium (ncbitaxon:40411) | - | PubMed (8968402) |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| Dihydro-bisdechlorogeodin (CHEBI:214866) is a benzofurans (CHEBI:35259) |
| IUPAC Name |
|---|
| methyl 4-hydroxy-3'-methoxy-6-methyl-3,5'-dioxospiro[1-benzouran-2,2'-cyclohex-3-ene]-1'-carboxylate |
| Manual Xrefs | Databases |
|---|---|
| 8791912 | ChemSpider |