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CHEBI:213650 - Aculeatusquinone B
| Formula | C17H20O6 |
| Net Charge | 0 |
| Average Mass | 320.341 |
| Monoisotopic Mass | 320.12599 |
| SMILES | CO[C@]1(C)C(=O)C(O)=C(C)C(=O)[C@H]1Oc1cc(C)cc(O)c1C |
| InChI | InChI=1S/C17H20O6/c1-8-6-11(18)9(2)12(7-8)23-16-14(20)10(3)13(19)15(21)17(16,4)22-5/h6-7,16,18-19H,1-5H3/t16-,17-/m1/s1 |
| InChIKey | NRPVNOLWZYAELE-IAGOWNOFSA-N |
| Species of Metabolite | Component | Source | Comments |
|---|---|---|---|
| Aspergillus aculeatus (ncbitaxon:5053) | - | DOI (10.3987/com-13-12667) |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| Aculeatusquinone B (CHEBI:213650) is a phenols (CHEBI:33853) |
| Aculeatusquinone B (CHEBI:213650) is a xylene (CHEBI:27338) |
| IUPAC Name |
|---|
| (5S,6S)-3-hydroxy-6-(3-hydroxy-2,5-dimethylphenoxy)-5-methoxy-2,5-dimethylcyclohex-2-ene-1,4-dione |
| Manual Xrefs | Databases |
|---|---|
| 29215666 | ChemSpider |