| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 14:40:42 UTC |
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| Update Date | 2025-03-25 00:46:47 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02157362 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C5H8N2O3S |
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| Molecular Mass | 176.0256 |
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| SMILES | O=C1NC(S)CC(C(=O)O)N1 |
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| InChI Key | PQSQNPJNGPOPGR-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 | alkylthiolsazacyclic compoundscarbonyl compoundscarboxylic acidsdiazinaneshydrocarbon derivativesmonocarboxylic acids and derivativesorganic carbonic acids and derivativesorganic oxidesorganonitrogen compoundsorganopnictogen compoundspyrimidonesthiohemiaminal derivatives |
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| Substituents | carbonyl groupcarbonic acid derivativecarboxylic acidazacyclepyrimidoneorganosulfur compoundpyrimidine1,3-diazinaneorganic oxidemonocarboxylic acid or derivativesorganic oxygen compoundaliphatic heteromonocyclic compoundorganonitrogen compoundalpha-amino acidhemithioaminalorganopnictogen compoundhydrocarbon derivativeorganic nitrogen compoundalkylthiolorganoheterocyclic compoundorganooxygen compound |
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