| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 00:03:13 UTC |
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| Update Date | 2025-03-21 18:07:32 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID00069877 |
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| Frequency | 43.1 |
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| Structure | |
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| Chemical Formula | C5H6O4S |
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| Molecular Mass | 161.9987 |
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| SMILES | O=C(O)C=CSCC(=O)O |
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| InChI Key | OKKGPWYRSRRGNJ-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 | dicarboxylic acids and derivatives |
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| Direct Parent | dicarboxylic acids and derivatives |
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| Geometric Descriptor | aliphatic acyclic compounds |
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| Alternative Parents | carbonyl compoundscarboxylic acidshydrocarbon derivativesorganic oxidessulfenyl compoundsthioenol ethersvinylogous thioesters |
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| Substituents | vinylogous thioesteraliphatic acyclic compoundcarbonyl groupcarboxylic acidsulfenyl compoundorganosulfur compoundorganic oxidethioenoletherorganic oxygen compounddicarboxylic acid or derivativeshydrocarbon derivativeorganooxygen compound |
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