EMBL-EBI | Chemical Biology | ChEBI
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| Formula | C8H18OS2 |
| Net Charge | 0 |
| Average Mass | 194.365 |
| Monoisotopic Mass | 194.07991 |
| SMILES | CC(O)C(C)SC(C)C(C)S |
| InChI | InChI=1S/C8H18OS2/c1-5(9)7(3)11-8(4)6(2)10/h5-10H,1-4H3 |
| InChIKey | PHLKBLKTWMSFGF-UHFFFAOYSA-N |
| Species of Metabolite | Component | Source | Comments |
|---|---|---|---|
| Homo sapiens (ncbitaxon:9606) | blood plasma (BTO:0000131) | MetaboLights (MTBLS2633) |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| 3-[(2-Mercapto-1-methylpropyl)thio]-2-butanol (CHEBI:172910) is a secondary alcohol (CHEBI:35681) |
| IUPAC Name |
|---|
| 3-(3-sulanylbutan-2-ylsulanyl)butan-2-ol |
| Manual Xrefs | Databases |
|---|---|
| HMDB0037295 | HMDB |
| 55927 | ChemSpider |
| Registry Numbers | Sources |
|---|---|
| CAS:54957-02-7 | ChemIDplus |