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CHEBI:216519 - Epicoccalone
| Formula | C16H16O7 |
| Net Charge | 0 |
| Average Mass | 320.297 |
| Monoisotopic Mass | 320.08960 |
| SMILES | CC(=O)[C@H](C)C(=O)c1cc2c(CO)c(C)c(O)c(O)c2oc1=O |
| InChI | InChI=1S/C16H16O7/c1-6(8(3)18)12(19)10-4-9-11(5-17)7(2)13(20)14(21)15(9)23-16(10)22/h4,6,17,20-21H,5H2,1-3H3/t6-/m0/s1 |
| InChIKey | KBIBOGJFVZOKCH-LURJTMIESA-N |
| Species of Metabolite | Component | Source | Comments |
|---|---|---|---|
| Epicoccumspecies (ncbitaxon:1859956) | - | DOI (10.1002/ejoc.200800447) |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| Epicoccalone (CHEBI:216519) is a hydroxycoumarin (CHEBI:37912) |
| IUPAC Name |
|---|
| 1-[7,8-dihydroxy-5-(hydroxymethyl)-6-methyl-2-oxochromen-3-yl]-2-methylbutane-1,3-dione |
| Manual Xrefs | Databases |
|---|---|
| 28285458 | ChemSpider |