| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 14:52:07 UTC |
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| Update Date | 2025-03-25 00:50:50 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02183300 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C5H5NO3S |
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| Molecular Mass | 158.999 |
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| SMILES | O=C1C=CSC(C(=O)O)N1 |
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| InChI Key | PNVSTKZEVCLGNS-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 | 1,3-thiazinesazacyclic compoundscarbonyl compoundscarboxylic acidshydrocarbon derivativeslactamsmonocarboxylic acids and derivativesorganic oxidesorganonitrogen compoundsorganopnictogen compoundssecondary carboxylic acid amidesthioenol ethersthiohemiaminal derivativesvinylogous thioesters |
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| Substituents | vinylogous thioestercarbonyl grouplactamcarboxylic acidazacyclecarboxamide groupsecondary carboxylic acid amideorganic oxidemonocarboxylic acid or derivativesthioenoletherorganic oxygen compoundaliphatic heteromonocyclic compoundorganonitrogen compoundalpha-amino acidhemithioaminalorganopnictogen compoundmeta-thiazinehydrocarbon derivativeorganic nitrogen compoundorganoheterocyclic compoundorganooxygen compound |
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