EMBL-EBI | Chemical Biology | ChEBI
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| Formula | C9H14O5 |
| Net Charge | 0 |
| Average Mass | 202.206 |
| Monoisotopic Mass | 202.08412 |
| SMILES | CC(O)[C@]1(O)C[C@@H]2C(=O)O[C@H](C)[C@@H]2O1 |
| InChI | InChI=1S/C9H14O5/c1-4-7-6(8(11)13-4)3-9(12,14-7)5(2)10/h4-7,10,12H,3H2,1-2H3/t4-,5?,6+,7+,9+/m1/s1 |
| InChIKey | OSHDOVSHADANKN-COIGFRBESA-N |
| Species of Metabolite | Component | Source | Comments |
|---|---|---|---|
| Aspergillus (ncbitaxon:5052) | - | PubMed (31580152) |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| Asperochrin E (CHEBI:205875) is a furofuran (CHEBI:47790) |
| IUPAC Names |
|---|
| (2S,3aS,6R,6aR)-2-hydroxy-2-(1-hydroxyethyl)-6-methyl-3,3a,6,6a-tetrahydrouro[2,3-c]uran-4-one |
| (2R,3aS,6R,6aR)-2-hydroxy-2-(1-hydroxyethyl)-6-methyl-3,3a,6,6a-tetrahydrouro[2,3-c]uran-4-one |