| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 00:18:43 UTC |
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| Update Date | 2025-03-21 18:35:46 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID00107211 |
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| Frequency | 25.1 |
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| Structure | |
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| Chemical Formula | C5H8N2O5S |
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| Molecular Mass | 208.0154 |
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| SMILES | O=NSCC(O)C(=O)NCC(=O)O |
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| InChI Key | QPRFSIMGHHBOHN-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 | alpha amino acidscarbonyl compoundscarboxylic acidshydrocarbon derivativesmonocarboxylic acids and derivativesmonosaccharidesnitrosothiolsorganic oxidesorganopnictogen compoundssecondary alcoholssecondary carboxylic acid amidessulfenyl compounds |
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| Substituents | aliphatic acyclic compoundcarbonyl groupcarboxylic acidmonosaccharideorganosulfur compoundnitrosothiolsaccharideorganic oxideorganonitrogen compoundalpha-amino acidorganopnictogen compoundorganic s-nitroso compoundalcoholorganic nitroso compoundsulfenyl compoundcarboxamide groupn-acylglycinesecondary carboxylic acid amidemonocarboxylic acid or derivativesorganic oxygen compoundsecondary alcoholhydrocarbon derivativeorganic nitrogen compoundorganooxygen compoundnitrosothiol-group |
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