EMBL-EBI | Chemical Biology | ChEBI
Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search
| Formula | C6H14OS |
| Net Charge | 0 |
| Average Mass | 134.244 |
| Monoisotopic Mass | 134.07654 |
| SMILES | CCCC(C)(S)CO |
| InChI | InChI=1S/C6H14OS/c1-3-4-6(2,8)5-7/h7-8H,3-5H2,1-2H3 |
| InChIKey | KMWFJTAZFAREIH-UHFFFAOYSA-N |
| Species of Metabolite | Component | Source | Comments |
|---|---|---|---|
| synthetic microbial community (ncbitaxon:3229850) | Whole Organism (NCIT:C13413) | MetaboLights (MTBLS3129) |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| 2-Mercapto-2-methyl-1-pentanol (CHEBI:193634) is a alkanethiol (CHEBI:47908) |
| IUPAC Name |
|---|
| 2-methyl-2-sulanylpentan-1-ol |
| Manual Xrefs | Databases |
|---|---|
| 9415540 | ChemSpider |
| HMDB0032374 | HMDB |
| Registry Numbers | Sources |
|---|---|
| CAS:258823-39-1 | ChemIDplus |