| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 15:18:07 UTC |
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| Update Date | 2025-03-25 01:00:26 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02242679 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C6H7NO3S |
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| Molecular Mass | 173.0147 |
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| SMILES | CC(=O)N1CSC=C1C(=O)O |
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| InChI Key | WOLLQQVRQCKTNQ-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 | acetamidesazacyclic compoundscarbonyl compoundscarboxylic acidshydrocarbon derivativesmonocarboxylic acids and derivativesorganic oxidesorganonitrogen compoundsorganopnictogen compoundstertiary carboxylic acid amidesthiazolecarboxylic acids and derivativesthiazolinesthioenol ethersthiohemiaminal derivativesvinylogous thioesters |
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| Substituents | carbonyl groupcarboxylic acidmeta-thiazolinethiazolecarboxylic acid or derivativesorganic oxidetertiary carboxylic acid amidealiphatic heteromonocyclic compoundorganonitrogen compoundalpha-amino acidhemithioaminalorganopnictogen compoundorganoheterocyclic compoundacetamidevinylogous thioesterazacyclecarboxamide groupmonocarboxylic acid or derivativesthioenoletherorganic oxygen compoundhydrocarbon derivativeorganic nitrogen compoundthiazoleorganooxygen compound |
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