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CHEBI:208517 - 4-O-methylconhypoprotocetraric acid
| Formula | C19H18O8 |
| Net Charge | 0 |
| Average Mass | 374.345 |
| Monoisotopic Mass | 374.10017 |
| SMILES | COc1cc(C)c2c(c1C)Oc1c(C)c(C(=O)O)c(O)c(CO)c1OC2=O |
| InChI | InChI=1S/C19H18O8/c1-7-5-11(25-4)8(2)15-12(7)19(24)27-17-10(6-20)14(21)13(18(22)23)9(3)16(17)26-15/h5,20-21H,6H2,1-4H3,(H,22,23) |
| InChIKey | HKJWQQPQBBPECX-UHFFFAOYSA-N |
| Species of Metabolite | Component | Source | Comments |
|---|---|---|---|
| Xanthoparmelia competita (ncbitaxon:1209524) | - | DOI (10.1071/ch00136) |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| 4-O-methylconhypoprotocetraric acid (CHEBI:208517) is a carbonyl compound (CHEBI:36586) |
| IUPAC Name |
|---|
| 3-hydroxy-4-(hydroxymethyl)-9-methoxy-1,7,10-trimethyl-6-oxobenzo[b][1,4]benzodioxepine-2-carboxylic acid |
| Manual Xrefs | Databases |
|---|---|
| 78436013 | ChemSpider |