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CHEBI:16445 - stipitatonic acid
| Formula | C9H4O6 |
| Net Charge | 0 |
| Average Mass | 208.125 |
| Monoisotopic Mass | 208.00079 |
| SMILES | O=C1OC(=O)c2c(O)cc(=O)c(O)cc21 |
| InChI | InChI=1S/C9H4O6/c10-4-1-3-7(6(12)2-5(4)11)9(14)15-8(3)13/h1-2,12H,(H,10,11) |
| InChIKey | IECSWTFJOUGQFO-UHFFFAOYSA-N |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| stipitatonic acid (CHEBI:16445) is a cyclic dicarboxylic anhydride (CHEBI:36609) |
| stipitatonic acid (CHEBI:16445) is a cycloheptafuran (CHEBI:39435) |
| stipitatonic acid (CHEBI:16445) is conjugate acid of stipitaton-4-olate (CHEBI:57775) |
| Incoming Relation(s) |
| stipitaton-4-olate (CHEBI:57775) is conjugate base of stipitatonic acid (CHEBI:16445) |
| IUPAC Name |
|---|
| 4,7-dihydroxy-1H-cyclohepta[c]furan-1,3,6-trione |
| Synonyms | Source |
|---|---|
| Stipitatonate | KEGG COMPOUND |
| 3,6-dihydroxy-5-oxocyclohepta-1,3,6-triene-1,2-dicarboxylic anhydride | ChEBI |
| stipitatonic acid | ChemIDplus |
| 3,6-dihydroxy-5-oxo-1,3,6-cycloheptatriene-1,2-dicarboxylic anhydride | ChemIDplus |