| Record Information |
|---|
| HMDB Status | expected |
|---|
| Creation Date | 2024-02-20 23:35:37 UTC |
|---|
| Update Date | 2025-03-21 17:57:02 UTC |
|---|
| HMDB ID | HMDB0031322 |
|---|
| Metabolite Identification |
|---|
| DeepMet ID | DMID00005271 |
|---|
| Name | 1-Butanethiol |
|---|
| Frequency | 1020.7 |
|---|
| Structure | |
|---|
| Chemical Formula | C4H10S |
|---|
| Molecular Mass | 90.0503 |
|---|
| SMILES | CCCCS |
|---|
| InChI Key | WQAQPCDUOCURKW-UHFFFAOYSA-N |
|---|
| Chemical Taxonomy |
|---|
| Kingdom | organic compounds |
|---|
| Superclass | organosulfur compounds |
|---|
| Class | thiols |
|---|
| Subclass | alkylthiols |
|---|
| Direct Parent | alkylthiols |
|---|
| Geometric Descriptor | aliphatic acyclic compounds |
|---|
| Alternative Parents | hydrocarbon derivativesorganosulfur compounds |
|---|
| Substituents | aliphatic acyclic compoundhydrocarbon derivativealkylthiol |
|---|
