| Record Information |
|---|
| HMDB Status | Not Available |
|---|
| Creation Date | 2024-02-21 01:07:32 UTC |
|---|
| Update Date | 2025-03-21 19:04:24 UTC |
|---|
| HMDB ID | Not Available |
|---|
| Metabolite Identification |
|---|
| DeepMet ID | DMID00221721 |
|---|
| Frequency | 9.8 |
|---|
| Structure | |
|---|
| Chemical Formula | C7H12OS |
|---|
| Molecular Mass | 144.0609 |
|---|
| SMILES | CCCC(C=O)=CSC |
|---|
| InChI Key | URJVMSBTDSLBID-UHFFFAOYSA-N |
|---|
| Chemical Taxonomy |
|---|
| Kingdom | organic compounds |
|---|
| Superclass | organic acids and derivatives |
|---|
| Class | vinylogous thioesters |
|---|
| Subclass | vinylogous thioesters |
|---|
| Direct Parent | vinylogous thioesters |
|---|
| Geometric Descriptor | aliphatic acyclic compounds |
|---|
| Alternative Parents | aldehydeshydrocarbon derivativesorganic oxidessulfenyl compoundsthioenol ethers |
|---|
| Substituents | vinylogous thioesteraliphatic acyclic compoundcarbonyl grouporganic oxidethioenoletherorganic oxygen compoundsulfenyl compoundaldehydehydrocarbon derivativeorganosulfur compoundorganooxygen compound |
|---|
