EMBL-EBI | Chemical Biology | ChEBI
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| Formula | C12H18O5 |
| Net Charge | 0 |
| Average Mass | 242.271 |
| Monoisotopic Mass | 242.11542 |
| SMILES | CCCC(O)[C@H]1OCC2=C1[C@@H](O)[C@H]1O[C@H]1[C@@H]2O |
| InChI | InChI=1S/C12H18O5/c1-2-3-6(13)10-7-5(4-16-10)8(14)11-12(17-11)9(7)15/h6,8-15H,2-4H2,1H3/t6?,8-,9-,10-,11+,12-/m1/s1 |
| InChIKey | SRPYFEBUZUGTPY-UARVUDJCSA-N |
| Species of Metabolite | Component | Source | Comments |
|---|---|---|---|
| Phaeoacremoniumspecies NRRL 32148 (ncbitaxon:1054402) | - | PubMed (16441079) |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| Phaeofuran B (CHEBI:203075) is a dihydrofuran (CHEBI:51659) |
| IUPAC Name |
|---|
| (1aR,2R,3S,6R,6aS)-3-(1-hydroxybutyl)-1a,2,3,5,6,6a-hexahydrooxireno[2,3-][2]benzouran-2,6-diol |
| Manual Xrefs | Databases |
|---|---|
| 9855040 | ChemSpider |