EMBL-EBI | Chemical Biology | ChEBI
Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search
| Formula | C8H14O3 |
| Net Charge | 0 |
| Average Mass | 158.197 |
| Monoisotopic Mass | 158.09429 |
| SMILES | C[C@@H]1[C@H](O)[C@@H](C)C(=O)O[C@H]1C |
| InChI | InChI=1S/C8H14O3/c1-4-6(3)11-8(10)5(2)7(4)9/h4-7,9H,1-3H3/t4-,5+,6-,7-/m0/s1 |
| InChIKey | WIPAYFJRYZXVMZ-VZFHVOOUSA-N |
| Species of Metabolite | Component | Source | Comments |
|---|---|---|---|
| Streptomyces (ncbitaxon:1883) | - | PubMed (28375005) |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| (3R*,4S*,5R*,6S*)-tetrahydro-4-hydroxy-3,5,6-trimethyl-2-pyranone (CHEBI:207290) is a δ-lactone (CHEBI:18946) |
| IUPAC Name |
|---|
| (3R,4S,5R,6S)-4-hydroxy-3,5,6-trimethyloxan-2-one |
| Manual Xrefs | Databases |
|---|---|
| 78443327 | ChemSpider |