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CHEBI:213411 - Parmosidone F
| Formula | C22H20O9 |
| Net Charge | 0 |
| Average Mass | 428.393 |
| Monoisotopic Mass | 428.11073 |
| SMILES | COCc1c(O)c(C(=O)O)c(C)c2c1OC(=O)c1c(C)cc(O)c(/C=C/C(C)=O)c1O2 |
| InChI | InChI=1S/C22H20O9/c1-9-7-14(24)12(6-5-10(2)23)19-15(9)22(28)31-20-13(8-29-4)17(25)16(21(26)27)11(3)18(20)30-19/h5-7,24-25H,8H2,1-4H3,(H,26,27)/b6-5+ |
| InChIKey | XDTRDIVWNWJBMN-AATRIKPKSA-N |
| Species of Metabolite | Component | Source | Comments |
|---|---|---|---|
| Parmotrema (ncbitaxon:172634) | - | PubMed (32483775) | |
| Parmotrema dilatatum (ncbitaxon:2559076) | - | PubMed (32819010) |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| Parmosidone F (CHEBI:213411) is a carbonyl compound (CHEBI:36586) |
| IUPAC Names |
|---|
| 12-[(2,4-dihydroxy-6-methylphenyl)methyl]-5,13,17-trihydroxy-7-methyl-9,15-dioxo-2,10,16-trioxatetracyclo[9.7.0.03,8.014,18]octadeca-1(11),3(8),4,6,12,14(18)-hexaene-4-carbaldehyde |
| 3,9-dihydroxy-4-(methoxymethyl)-1,7-dimethyl-6-oxo-10-[(E)-3-oxobut-1-enyl]benzo[b][1,4]benzodioxepine-2-carboxylic acid |