| Record Information |
|---|
| HMDB Status | Not Available |
|---|
| Creation Date | 2024-02-20 23:47:40 UTC |
|---|
| Update Date | 2025-03-21 18:01:26 UTC |
|---|
| HMDB ID | Not Available |
|---|
| Metabolite Identification |
|---|
| DeepMet ID | DMID00032931 |
|---|
| Frequency | 110.6 |
|---|
| Structure | |
|---|
| Chemical Formula | C6H13NO12S2 |
|---|
| Molecular Mass | 354.9879 |
|---|
| SMILES | O=S(=O)(O)OCC1OC(O)C(NOS(=O)(=O)O)C(O)C1O |
|---|
| InChI Key | QHWXQGQQDOTSHV-UHFFFAOYSA-N |
|---|
| Chemical Taxonomy |
|---|
| Kingdom | organic compounds |
|---|
| Superclass | organic oxygen compounds |
|---|
| Class | organooxygen compounds |
|---|
| Subclass | carbohydrates and carbohydrate conjugates |
|---|
| Direct Parent | monosaccharides |
|---|
| Geometric Descriptor | aliphatic heteromonocyclic compounds |
|---|
| Alternative Parents | 1,2-diolsalkyl sulfateshemiacetalshydrocarbon derivativesorganic oxidesorganonitrogen compoundsorganopnictogen compoundsoxacyclic compoundsoxanessecondary alcoholssulfuric acid monoesters |
|---|
| Substituents | alcoholsulfuric acid monoesterorganic sulfuric acid or derivativesmonosaccharideoxacycleorganic oxidealkyl sulfatealiphatic heteromonocyclic compoundorganonitrogen compoundsecondary alcoholorganopnictogen compoundsulfate-esterhemiacetalhydrocarbon derivativeorganic nitrogen compoundoxanesulfuric acid esterorganoheterocyclic compound1,2-diol |
|---|
