EMBL-EBI | Chemical Biology | ChEBI
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| Formula | C16H14O8 |
| Net Charge | 0 |
| Average Mass | 334.280 |
| Monoisotopic Mass | 334.06887 |
| SMILES | COC(=O)[C@]12Oc3cc(C)cc(O)c3C(O)=C1C(=O)OC=C[C@H]2O |
| InChI | InChI=1S/C16H14O8/c1-7-5-8(17)11-9(6-7)24-16(15(21)22-2)10(18)3-4-23-14(20)12(16)13(11)19/h3-6,10,17-19H,1-2H3/t10-,16-/m1/s1 |
| InChIKey | LJZIATQTOHOMBR-QLJPJBMISA-N |
| Species of Metabolite | Component | Source | Comments |
|---|---|---|---|
| Coniochaetaspecies (ncbitaxon:1849801) | - | PubMed (20405881) |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| Conioxepinol D (CHEBI:201928) is a 1-benzopyran (CHEBI:38443) |
| IUPAC Name |
|---|
| methyl (5R,5aS)-5,10,11-trihydroxy-8-methyl-1-oxo-5H-oxepino[4,3-b]chromene-5a-carboxylate |
| Manual Xrefs | Databases |
|---|---|
| 78436788 | ChemSpider |