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CHEBI:203097 - Oxyphysodic acid
| Formula | C27H32O9 |
| Net Charge | 0 |
| Average Mass | 500.544 |
| Monoisotopic Mass | 500.20463 |
| SMILES | CCCCCC(=O)Cc1cc(O)c(O)c2c1C(=O)Oc1c(C)c(O)c(C(=O)O)c(CCCCC)c1O2 |
| InChI | InChI=1S/C27H32O9/c1-4-6-8-10-16(28)12-15-13-18(29)22(31)25-19(15)27(34)36-23-14(3)21(30)20(26(32)33)17(24(23)35-25)11-9-7-5-2/h13,29-31H,4-12H2,1-3H3,(H,32,33) |
| InChIKey | MFQPDORCAZXDCT-UHFFFAOYSA-N |
| Species of Metabolite | Component | Source | Comments |
|---|---|---|---|
| Parmelia (ncbitaxon:87260) | - | PubMed (4434602) |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| Oxyphysodic acid (CHEBI:203097) is a carbonyl compound (CHEBI:36586) |
| IUPAC Name |
|---|
| 3,9,10-trihydroxy-4-methyl-6-oxo-7-(2-oxoheptyl)-1-pentylbenzo[b][1,4]benzodioxepine-2-carboxylic acid |
| Manual Xrefs | Databases |
|---|---|
| 9412407 | ChemSpider |