| Record Information |
|---|
| HMDB Status | Not Available |
|---|
| Creation Date | 2024-02-21 15:00:32 UTC |
|---|
| Update Date | 2025-03-25 00:53:51 UTC |
|---|
| HMDB ID | Not Available |
|---|
| Metabolite Identification |
|---|
| DeepMet ID | DMID02202459 |
|---|
| Frequency | 0.5 |
|---|
| Structure | |
|---|
| Chemical Formula | C14H26O20S3 |
|---|
| Molecular Mass | 610.018 |
|---|
| SMILES | COC1OC(COS(=O)(=O)O)C(O)C(OC2C(COS(=O)(=O)O)OC(OC)C(O)C2OS(=O)(=O)O)C1O |
|---|
| InChI Key | YXNJSQCFWLNQHI-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 | acetalsalkyl sulfatesdialkyl ethershydrocarbon derivativesorganic oxidesoxacyclic compoundsoxanessecondary alcoholssulfuric acid monoesters |
|---|
| Substituents | alcoholsulfuric acid monoesteretherorganic sulfuric acid or derivativesmonosaccharidedialkyl etheroxacycleorganic oxideacetalalkyl sulfatealiphatic heteromonocyclic compoundsecondary alcoholsulfate-esterhydrocarbon derivativeoxanesulfuric acid esterorganoheterocyclic compound |
|---|