| Record Information |
|---|
| HMDB Status | Not Available |
|---|
| Creation Date | 2024-02-21 14:46:20 UTC |
|---|
| Update Date | 2025-03-25 00:48:46 UTC |
|---|
| HMDB ID | Not Available |
|---|
| Metabolite Identification |
|---|
| DeepMet ID | DMID02170060 |
|---|
| Frequency | 0.5 |
|---|
| Structure | |
|---|
| Chemical Formula | C16H32O3S2 |
|---|
| Molecular Mass | 336.1793 |
|---|
| SMILES | CCCCCCCCCCCCCC=CCSS(=O)(=O)O |
|---|
| InChI Key | QKMDFEPEJSTTEY-UHFFFAOYSA-N |
|---|
| Chemical Taxonomy |
|---|
| Kingdom | organic compounds |
|---|
| Superclass | organic acids and derivatives |
|---|
| Class | organic thiosulfuric acids and derivatives |
|---|
| Subclass | s-alkyl thiosulfates |
|---|
| Direct Parent | s-alkyl thiosulfates |
|---|
| Geometric Descriptor | aliphatic acyclic compounds |
|---|
| Alternative Parents | hydrocarbon derivativesorganic oxidessulfenyl compounds |
|---|
| Substituents | aliphatic acyclic compoundorganic oxideorganic oxygen compoundsulfenyl compoundhydrocarbon derivativeorganosulfur compounds-alkyl thiosulfate |
|---|
