EMBL-EBI | Chemical Biology | ChEBI
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| Formula | C21H14O8 |
| Net Charge | 0 |
| Average Mass | 394.335 |
| Monoisotopic Mass | 394.06887 |
| SMILES | CO[C@]1(O)[C@H]2O[C@H]2C2(Oc3cccc4cccc(c34)O2)[C@@]23O[C@]21C(=O)C=CC3=O |
| InChI | InChI=1S/C21H14O8/c1-25-20(24)16-17(26-16)21(19-14(23)9-8-13(22)18(19,20)29-19)27-11-6-2-4-10-5-3-7-12(28-21)15(10)11/h2-9,16-17,24H,1H3/t16-,17+,18+,19-,20+/m0/s1 |
| InChIKey | MYXNJIZFJSNFMA-MFKWGIFDSA-N |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| Sch 50673 (CHEBI:213055) is a naphthalenes (CHEBI:25477) |
| IUPAC Name |
|---|
| (1'S,2'R,3'S,5'R,7'R)-2'-hydroxy-2'-methoxyspiro[2,4-dioxatricyclo[7.3.1.05,13]trideca-1(12),5,7,9(13),10-pentaene-3,6'-4,12-dioxatetracyclo[5.4.1.01,7.03,5]dodec-9-ene]-8',11'-dione |
| Manual Xrefs | Databases |
|---|---|
| 8128120 | ChemSpider |