| Record Information |
|---|
| HMDB Status | Not Available |
|---|
| Creation Date | 2024-02-21 00:01:34 UTC |
|---|
| Update Date | 2025-03-21 18:06:54 UTC |
|---|
| HMDB ID | Not Available |
|---|
| Metabolite Identification |
|---|
| DeepMet ID | DMID00065888 |
|---|
| Frequency | 46.4 |
|---|
| Structure | |
|---|
| Chemical Formula | C9H12S |
|---|
| Molecular Mass | 152.066 |
|---|
| SMILES | CSc1c(C)cccc1C |
|---|
| InChI Key | ITVXUDPAZIIEKD-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 ethersm-xylenes |
|---|
| Substituents | monocyclic benzene moietysulfenyl compoundm-xylenealkylarylthioetherorganosulfur compoundaryl thioetheraromatic homomonocyclic compoundxylenethiophenolthioetherthiophenol etherhydrocarbon derivative |
|---|
