EMBL-EBI | Chemical Biology | ChEBI
Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search
| Formula | C5H10OS |
| Net Charge | 0 |
| Average Mass | 118.201 |
| Monoisotopic Mass | 118.04524 |
| SMILES | CCC(=O)C(C)S |
| InChI | InChI=1S/C5H10OS/c1-3-5(6)4(2)7/h4,7H,3H2,1-2H3 |
| InChIKey | TWOGJUHCCNLYPC-UHFFFAOYSA-N |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| 2-Mercapto-3-pentanone (CHEBI:173444) is a ketone (CHEBI:17087) |
| IUPAC Name |
|---|
| 2-sulanylpentan-3-one |
| Manual Xrefs | Databases |
|---|---|
| 461501 | ChemSpider |
| HMDB0035171 | HMDB |