| Record Information |
|---|
| HMDB Status | Not Available |
|---|
| Creation Date | 2024-02-21 03:19:38 UTC |
|---|
| Update Date | 2025-03-21 22:15:30 UTC |
|---|
| HMDB ID | Not Available |
|---|
| Metabolite Identification |
|---|
| DeepMet ID | DMID00531719 |
|---|
| Frequency | 3.2 |
|---|
| Structure | |
|---|
| Chemical Formula | C5H9NOS |
|---|
| Molecular Mass | 131.0405 |
|---|
| SMILES | CSC=C(C)C(N)=O |
|---|
| InChI Key | NFMXAOBLXGKPHC-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 | carbonyl compoundscarboxylic acids and derivativeshydrocarbon derivativesorganic oxidesorganonitrogen compoundsorganopnictogen compoundsprimary carboxylic acid amidessulfenyl compoundsthioenol ethers |
|---|
| Substituents | primary carboxylic acid amidevinylogous thioesteraliphatic acyclic compoundcarbonyl groupsulfenyl compoundorganosulfur compoundcarboxamide groupcarboxylic acid derivativeorganic oxidethioenoletherorganic oxygen compoundorganonitrogen compoundorganopnictogen compoundhydrocarbon derivativeorganic nitrogen compoundorganooxygen compound |
|---|
