| Record Information |
|---|
| HMDB Status | Not Available |
|---|
| Creation Date | 2024-02-20 23:50:40 UTC |
|---|
| Update Date | 2025-03-21 18:02:46 UTC |
|---|
| HMDB ID | Not Available |
|---|
| Metabolite Identification |
|---|
| DeepMet ID | DMID00040086 |
|---|
| Frequency | 86.4 |
|---|
| Structure | |
|---|
| Chemical Formula | C6H8O6S |
|---|
| Molecular Mass | 208.0042 |
|---|
| SMILES | O=C(O)C(=O)CSCC(O)C(=O)O |
|---|
| InChI Key | ZCBMFYQSHNBCSD-UHFFFAOYSA-N |
|---|
| Chemical Taxonomy |
|---|
| Kingdom | organic compounds |
|---|
| Superclass | organic acids and derivatives |
|---|
| Class | carboxylic acids and derivatives |
|---|
| Subclass | dicarboxylic acids and derivatives |
|---|
| Direct Parent | dicarboxylic acids and derivatives |
|---|
| Geometric Descriptor | aliphatic acyclic compounds |
|---|
| Alternative Parents | alpha hydroxy acids and derivativesalpha-hydroxy ketonesalpha-keto acids and derivativescarboxylic acidsdialkylthioethershydrocarbon derivativesmonosaccharidesorganic oxidessecondary alcoholssulfenyl compounds |
|---|
| Substituents | alcoholaliphatic acyclic compoundcarbonyl groupcarboxylic acidsulfenyl compounddialkylthioetheralpha-hydroxy acidmonosaccharidehydroxy acidorganosulfur compoundalpha-hydroxy ketoneketonesaccharideorganic oxideorganic oxygen compoundthioetherketo acidalpha-keto acidsecondary alcoholdicarboxylic acid or derivativeshydrocarbon derivativeorganooxygen compound |
|---|
