| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-20 23:48:13 UTC |
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| Update Date | 2025-03-21 18:01:41 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID00034236 |
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| Frequency | 163.7 |
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| Structure | |
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| Chemical Formula | C4H10N2O4S |
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| Molecular Mass | 182.0361 |
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| SMILES | NCC(=O)NCCS(=O)(=O)O |
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| InChI Key | CHJFZKBUNXDBEL-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 | alpha amino acid amides |
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| Geometric Descriptor | aliphatic acyclic compounds |
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| Alternative Parents | alpha amino acidscarbonyl compoundscarboxylic acids and derivativeshydrocarbon derivativesmonoalkylaminesorganic oxidesorganonitrogen compoundsorganopnictogen compoundsorganosulfonic acidssecondary carboxylic acid amidessulfonyls |
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| Substituents | aliphatic acyclic compoundorganosulfonic acid or derivativescarbonyl groupalpha-amino acid amideorganosulfonic acidorganosulfur compoundcarboxamide groupsecondary carboxylic acid amideorganic oxidesulfonylorganic oxygen compoundorganic sulfonic acid or derivativesorganonitrogen compoundalpha-amino acidorganopnictogen compoundhydrocarbon derivativeprimary aliphatic amineorganic nitrogen compoundorganooxygen compound |
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