| Record Information |
|---|
| HMDB Status | Not Available |
|---|
| Creation Date | 2024-02-20 23:39:52 UTC |
|---|
| Update Date | 2025-03-21 17:58:33 UTC |
|---|
| HMDB ID | Not Available |
|---|
| Metabolite Identification |
|---|
| DeepMet ID | DMID00015148 |
|---|
| Frequency | 288.2 |
|---|
| Structure | |
|---|
| Chemical Formula | C11H18OS |
|---|
| Molecular Mass | 198.1078 |
|---|
| SMILES | CSC=C(C)CC1(O)CC=CCC1 |
|---|
| InChI Key | PPVPKMNSUCQWJF-UHFFFAOYSA-N |
|---|
| Chemical Taxonomy |
|---|
| Kingdom | organic compounds |
|---|
| Superclass | organic oxygen compounds |
|---|
| Class | organooxygen compounds |
|---|
| Subclass | alcohols and polyols |
|---|
| Direct Parent | tertiary alcohols |
|---|
| Geometric Descriptor | aliphatic homomonocyclic compounds |
|---|
| Alternative Parents | hydrocarbon derivativessulfenyl compoundsthioenol ethers |
|---|
| Substituents | tertiary alcoholthioenolethersulfenyl compoundaliphatic homomonocyclic compoundhydrocarbon derivativeorganosulfur compound |
|---|
