| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 00:07:54 UTC |
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| Update Date | 2025-03-21 18:30:09 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID00081181 |
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| Frequency | 35.7 |
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| Structure | |
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| Chemical Formula | C3H6O5S2 |
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| Molecular Mass | 185.9657 |
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| SMILES | CC(SS(=O)(=O)O)C(=O)O |
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| InChI Key | IVSBZEZBUOBQOR-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 | organic thiosulfuric acids and derivatives |
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| Subclass | s-alkyl thiosulfates |
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| Direct Parent | s-alkyl thiosulfates |
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| Geometric Descriptor | aliphatic acyclic compounds |
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| Alternative Parents | carbonyl compoundscarboxylic acidshydrocarbon derivativesmonocarboxylic acids and derivativesorganic oxidessulfenyl compounds |
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| Substituents | aliphatic acyclic compoundcarbonyl groupcarboxylic acidsulfenyl compoundorganosulfur compoundcarboxylic acid derivatives-alkyl thiosulfateorganic oxidemonocarboxylic acid or derivativesorganic oxygen compoundhydrocarbon derivativeorganooxygen compound |
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