| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 14:49:10 UTC |
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| Update Date | 2025-03-25 00:49:47 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02176598 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C3H4NO5S+ |
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| Molecular Mass | 165.9805 |
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| SMILES | O=C(O)C1[N+]CS(=O)(=O)O1 |
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| InChI Key | SOEGTTSBVAMDTL-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 acids |
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| Geometric Descriptor | aliphatic heteromonocyclic compounds |
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| Alternative Parents | azacyclic compoundscarbonyl compoundscarboxylic acidshydrocarbon derivativesmonocarboxylic acids and derivativesorganic cationsorganic oxidesorganonitrogen compoundsorganopnictogen compoundsorganosulfonic acid estersoxacyclic compoundsoxathiazolidinessulfonic acid esters |
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| Substituents | organosulfonic acid or derivativescarbonyl groupcarboxylic acidazacycleorganosulfonic acid estersulfonic acid esteroxacycleorganic oxidemonocarboxylic acid or derivativesorganic oxygen compound1,2,4-oxathiazolidineorganic sulfonic acid or derivativesaliphatic heteromonocyclic compoundorganonitrogen compoundalpha-amino acidorganopnictogen compoundhydrocarbon derivativeorganic nitrogen compoundorganic cationorganoheterocyclic compoundorganooxygen compound |
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