| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-20 23:40:12 UTC |
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| Update Date | 2025-03-21 17:58:39 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID00015852 |
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| Frequency | 320.1 |
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| Structure | |
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| Chemical Formula | C5H11NO4S |
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| Molecular Mass | 181.0409 |
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| SMILES | CCC(=O)NCCS(=O)(=O)O |
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| InChI Key | CIPJBOMLFKUUEH-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 | organic sulfonic acids and derivatives |
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| Subclass | organosulfonic acids and derivatives |
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| Direct Parent | organosulfonic acids |
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| Geometric Descriptor | aliphatic acyclic compounds |
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| Alternative Parents | carbonyl compoundscarboxylic acids and derivativeshydrocarbon derivativesorganic oxidesorganonitrogen compoundsorganopnictogen compoundssecondary carboxylic acid amidessulfonyls |
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| Substituents | aliphatic acyclic compoundcarbonyl grouporganosulfonic acidorganosulfur compoundcarboxamide groupcarboxylic acid derivativesecondary carboxylic acid amideorganic oxidesulfonylorganic oxygen compoundorganonitrogen compoundorganopnictogen compoundhydrocarbon derivativeorganic nitrogen compoundorganooxygen compound |
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