EMBL-EBI | Chemical Biology | ChEBI
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| Formula | C16H16O7 |
| Net Charge | 0 |
| Average Mass | 320.297 |
| Monoisotopic Mass | 320.08960 |
| SMILES | COC(=O)[C@@H]1c2c(oc3cc(CO)cc(O)c3c2=O)CC[C@@H]1O |
| InChI | InChI=1S/C16H16O7/c1-22-16(21)13-8(18)2-3-10-14(13)15(20)12-9(19)4-7(6-17)5-11(12)23-10/h4-5,8,13,17-19H,2-3,6H2,1H3/t8-,13-/m0/s1 |
| InChIKey | MKTAQUYGAHEXED-SDBXPKJASA-N |
| Species of Metabolite | Component | Source | Comments |
|---|---|---|---|
| Engyodontium (ncbitaxon:73873) | - | PubMed (25501793) |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| Engyodontiumone C (CHEBI:216310) is a xanthones (CHEBI:51149) |
| IUPAC Name |
|---|
| methyl (1R,2S)-2,8-dihydroxy-6-(hydroxymethyl)-9-oxo-1,2,3,4-tetrahydroxanthene-1-carboxylate |
| Manual Xrefs | Databases |
|---|---|
| 34981900 | ChemSpider |