EMBL-EBI | Chemical Biology | ChEBI
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| Formula | C29H18O6 |
| Net Charge | 0 |
| Average Mass | 462.457 |
| Monoisotopic Mass | 462.11034 |
| SMILES | O=C1CC2CC(=O)c3c(O)ccc4c3C2C(=C2C=CC(=O)c3c(O)ccc-4c32)c2cccc(O)c21 |
| InChI | InChI=1S/C29H18O6/c30-17-3-1-2-15-25-16-6-9-19(32)28-18(31)7-4-13(24(16)28)14-5-8-20(33)29-22(35)11-12(23(25)27(14)29)10-21(34)26(15)17/h1-9,12,23,30-31,33H,10-11H2 |
| InChIKey | CGAKGJOUWCSJFA-UHFFFAOYSA-N |
| Species of Metabolite | Component | Source | Comments |
|---|---|---|---|
| Daldinia eschscholzii IFB-TL01 (ncbitaxon:1169046) | - | PubMed (27739305) |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| Selesconol (CHEBI:199502) is a tetralins (CHEBI:36786) |
| IUPAC Name |
|---|
| 7,14,22-trihydroxyheptacyclo[13.11.2.12,6.011,28.018,27.021,26.010,29]nonacosa-1,3,6,8,10(29),11(28),12,14,21(26),22,24-undecaene-5,16,20-trione |
| Manual Xrefs | Databases |
|---|---|
| 78435332 | ChemSpider |