| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 14:40:33 UTC |
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| Update Date | 2025-03-25 00:46:44 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02157005 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C5H9NO2S |
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| Molecular Mass | 147.0354 |
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| SMILES | O=C1SCNC1CCO |
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| InChI Key | OPRDXBQAQDRPTG-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 | alcohols and polyolsazacyclic compoundscarbonyl compoundscarbothioic s-lactonescarboxylic acids and derivativesdialkylamineshydrocarbon derivativesorganic oxidesorganopnictogen compoundsthiazolidinesthioestersthiohemiaminal derivativesthiolactones |
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| Substituents | carbonyl grouporganic oxidealiphatic heteromonocyclic compoundorganonitrogen compoundalpha-amino acidhemithioaminalorganopnictogen compoundthiolactoneorganoheterocyclic compoundcarbothioic s-lactonealcoholsecondary aliphatic aminethiocarboxylic acid or derivativesazacyclethiocarboxylic acid estersecondary amineorganic oxygen compoundhydrocarbon derivativeorganic nitrogen compoundorganooxygen compoundaminethiazolidine |
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