| Record Information |
|---|
| HMDB Status | Not Available |
|---|
| Creation Date | 2024-02-21 15:05:43 UTC |
|---|
| Update Date | 2025-03-25 00:55:52 UTC |
|---|
| HMDB ID | Not Available |
|---|
| Metabolite Identification |
|---|
| DeepMet ID | DMID02214585 |
|---|
| Frequency | 0.5 |
|---|
| Structure | |
|---|
| Chemical Formula | C11H14S |
|---|
| Molecular Mass | 178.0816 |
|---|
| SMILES | CC=CCSc1ccc(C)cc1 |
|---|
| InChI Key | URVOFOITCOBKOW-UHFFFAOYSA-N |
|---|
| Chemical Taxonomy |
|---|
| Kingdom | organic compounds |
|---|
| Superclass | benzenoids |
|---|
| Class | thiophenols |
|---|
| Subclass | thiophenols |
|---|
| Direct Parent | thiophenols |
|---|
| Geometric Descriptor | aromatic homomonocyclic compounds |
|---|
| Alternative Parents | alkylarylthioethershydrocarbon derivativessulfenyl compoundsthiophenol etherstoluenes |
|---|
| Substituents | monocyclic benzene moietysulfenyl compoundalkylarylthioetherorganosulfur compoundaryl thioetheraromatic homomonocyclic compoundthiophenolthioetherthiophenol etherhydrocarbon derivativetoluene |
|---|
