| Record Information |
|---|
| HMDB Status | Not Available |
|---|
| Creation Date | 2024-02-20 23:52:55 UTC |
|---|
| Update Date | 2025-03-21 18:03:38 UTC |
|---|
| HMDB ID | Not Available |
|---|
| Metabolite Identification |
|---|
| DeepMet ID | DMID00045578 |
|---|
| Frequency | 73.8 |
|---|
| Structure | |
|---|
| Chemical Formula | C8H10O2S |
|---|
| Molecular Mass | 170.0402 |
|---|
| SMILES | Oc1cccc(C(O)CS)c1 |
|---|
| InChI Key | DVJSEYYXELWIJW-UHFFFAOYSA-N |
|---|
| Chemical Taxonomy |
|---|
| Kingdom | organic compounds |
|---|
| Superclass | benzenoids |
|---|
| Class | phenols |
|---|
| Subclass | 1-hydroxy-2-unsubstituted benzenoids |
|---|
| Direct Parent | 1-hydroxy-2-unsubstituted benzenoids |
|---|
| Geometric Descriptor | aromatic homomonocyclic compounds |
|---|
| Alternative Parents | 1-hydroxy-4-unsubstituted benzenoidsalkylthiolsaromatic alcoholsbenzene and substituted derivativeshydrocarbon derivativesorganosulfur compoundssecondary alcohols |
|---|
| Substituents | aromatic alcoholalcoholmonocyclic benzene moiety1-hydroxy-2-unsubstituted benzenoid1-hydroxy-4-unsubstituted benzenoidorganosulfur compoundaromatic homomonocyclic compoundorganic oxygen compoundsecondary alcoholhydrocarbon derivativealkylthiolorganooxygen compound |
|---|
