EMBL-EBI | Chemical Biology | ChEBI
Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search
| Formula | C6H8O3 |
| Net Charge | 0 |
| Average Mass | 128.127 |
| Monoisotopic Mass | 128.04734 |
| SMILES | CC1OC(=O)C=CC1O |
| InChI | InChI=1S/C6H8O3/c1-4-5(7)2-3-6(8)9-4/h2-5,7H,1H3 |
| InChIKey | TVDPVFPVOHCHQM-UHFFFAOYSA-N |
| Species of Metabolite | Component | Source | Comments |
|---|---|---|---|
| Tapinella atrotomentosa (ncbitaxon:72122) | - | DOI (10.1016/0031-9422(95)00467-l) |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| Osmundalactone (CHEBI:173475) is a pyranone (CHEBI:37963) |
| IUPAC Names |
|---|
| 3-hydroxy-2-methyl-2,3-dihydropyran-6-one |
| (2R,3S)-3-hydroxy-2-methyl-2,3-dihydropyran-6-one |
| Manual Xrefs | Databases |
|---|---|
| HMDB0031303 | HMDB |
| 28719928 | ChemSpider |
| 10232880 | ChemSpider |