| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 00:00:21 UTC |
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| Update Date | 2025-03-21 18:06:24 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID00062992 |
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| Frequency | 49.1 |
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| Structure | |
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| Chemical Formula | C4H7NO6S |
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| Molecular Mass | 196.9994 |
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| SMILES | CC(=O)NCC(=O)OS(=O)(=O)O |
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| InChI Key | BPAHCJGZDSHMFR-UHFFFAOYSA-N |
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| Chemical Taxonomy |
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| Kingdom | organic compounds |
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| Superclass | organic acids and derivatives |
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| Class | carboxylic acids and derivatives |
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| Subclass | amino acids, peptides, and analogues |
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| Direct Parent | acyl glycines |
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| Geometric Descriptor | aliphatic acyclic compounds |
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| Alternative Parents | acetamidesalpha amino acidscarbonyl compoundshydrocarbon derivativesmonocarboxylic acids and derivativesorganic oxidesorganonitrogen compoundsorganopnictogen compoundssecondary carboxylic acid amidessulfuric acid monoesters |
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| Substituents | aliphatic acyclic compoundsulfuric acid monoestercarbonyl grouporganic sulfuric acid or derivativescarboxamide groupn-acylglycinesecondary carboxylic acid amideorganic oxidemonocarboxylic acid or derivativesorganic oxygen compoundorganonitrogen compoundalpha-amino acidorganopnictogen compoundhydrocarbon derivativeorganic nitrogen compoundsulfuric acid esteracetamideorganooxygen compound |
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