| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 14:50:30 UTC |
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| Update Date | 2025-03-25 00:50:14 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02179651 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C6H10O5S |
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| Molecular Mass | 194.0249 |
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| SMILES | CSC1(O)CC(O)C(C(=O)O)O1 |
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| InChI Key | ODZJNAAYCDIVEV-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 | hydroxy acids and derivatives |
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| Subclass | beta hydroxy acids and derivatives |
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| Direct Parent | beta hydroxy acids and derivatives |
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| Geometric Descriptor | aliphatic heteromonocyclic compounds |
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| Alternative Parents | carbonyl compoundscarboxylic acidshydrocarbon derivativesmonocarboxylic acids and derivativesmonosaccharidesmonothioacetalsorganic oxidesoxacyclic compoundssecondary alcoholssulfenyl compoundstetrahydrofurans |
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| Substituents | alcoholcarbonyl groupcarboxylic acidsulfenyl compoundtetrahydrofuranmonosaccharideorganosulfur compoundcarboxylic acid derivativemonothioacetaloxacyclebeta-hydroxy acidsaccharideorganic oxidemonocarboxylic acid or derivativesorganic oxygen compoundaliphatic heteromonocyclic compoundsecondary alcoholhydrocarbon derivativeorganoheterocyclic compoundorganooxygen compound |
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