| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-20 23:52:28 UTC |
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| Update Date | 2025-03-21 18:03:29 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID00044482 |
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| Frequency | 76.0 |
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| Structure | |
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| Chemical Formula | C4H8O7S |
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| Molecular Mass | 199.9991 |
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| SMILES | O=CC(O)C(O)COS(=O)(=O)O |
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| InChI Key | CHBNHVNJBDTLAM-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 sulfuric acids and derivatives |
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| Subclass | sulfuric acid esters |
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| Direct Parent | sulfuric acid monoesters |
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| Geometric Descriptor | aliphatic acyclic compounds |
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| Alternative Parents | 1,2-diolsalkyl sulfatesalpha-hydroxyaldehydesbeta-hydroxy aldehydeshydrocarbon derivativesmonosaccharidesorganic oxidessecondary alcohols |
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| Substituents | alcoholaliphatic acyclic compoundbeta-hydroxy aldehydesulfuric acid monoestercarbonyl groupmonosaccharidealdehydesaccharideorganic oxidealpha-hydroxyaldehydeorganic oxygen compoundalkyl sulfatesecondary alcoholsulfate-esterhydrocarbon derivativeorganooxygen compound1,2-diol |
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