Record Information |
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HMDB Status | Not Available |
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Creation Date | 2024-02-21 14:37:28 UTC |
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Update Date | 2025-03-25 00:45:34 UTC |
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HMDB ID | Not Available |
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Metabolite Identification |
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DeepMet ID | DMID02149898 |
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Frequency | 0.5 |
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Structure | |
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Chemical Formula | C6H12O5S |
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Molecular Mass | 196.0405 |
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SMILES | CCOS(=O)(=O)OC(=O)C(C)C |
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InChI Key | WOBIOAOLJKTMKU-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 diesters |
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Geometric Descriptor | aliphatic acyclic compounds |
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Alternative Parents | alkyl sulfatescarbonyl compoundshydrocarbon derivativesmonocarboxylic acids and derivativesorganic oxides |
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Substituents | aliphatic acyclic compoundcarbonyl groupcarboxylic acid derivativeorganic oxidemonocarboxylic acid or derivativesorganic oxygen compoundsulfuric acid diesteralkyl sulfatehydrocarbon derivativeorganooxygen compound |
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