| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 15:12:02 UTC |
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| Update Date | 2025-03-25 00:58:09 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02228867 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C9H18N2O7S |
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| Molecular Mass | 298.0835 |
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| SMILES | CC(=O)NC1C(N)OC(COS(C)(=O)=O)C(O)C1O |
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| InChI Key | IJRSYVAVNCKXOF-UHFFFAOYSA-N |
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| Chemical Taxonomy |
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| Kingdom | organic compounds |
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| Superclass | organic oxygen compounds |
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| Class | organooxygen compounds |
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| Subclass | carbohydrates and carbohydrate conjugates |
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| Direct Parent | monosaccharides |
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| Geometric Descriptor | aliphatic heteromonocyclic compounds |
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| Alternative Parents | 1,2-diolsacetamidescarbonyl compoundscarboxylic acids and derivativeshemiaminalshydrocarbon derivativesmethanesulfonatesmonoalkylaminesorganic oxidesorganonitrogen compoundsorganopnictogen compoundsorganosulfonic acid estersoxacyclic compoundsoxanessecondary alcoholssecondary carboxylic acid amidessulfonic acid esterssulfonyls |
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| Substituents | organosulfonic acid or derivativescarbonyl groupmonosaccharideorganosulfur compoundcarboxylic acid derivativehemiaminalsulfonic acid esterorganic oxidealiphatic heteromonocyclic compoundorganonitrogen compoundorganopnictogen compoundoxaneorganoheterocyclic compoundacetamide1,2-diolalcoholcarboxamide grouporganosulfonic acid estermethanesulfonateoxacyclesecondary carboxylic acid amidesulfonylorganic sulfonic acid or derivativessecondary alcoholhydrocarbon derivativeprimary aliphatic amineorganic nitrogen compound |
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