| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-20 23:56:38 UTC |
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| Update Date | 2025-03-21 18:05:01 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID00054193 |
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| Frequency | 59.5 |
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| Structure | |
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| Chemical Formula | C4H4O5S |
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| Molecular Mass | 163.9779 |
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| SMILES | CC1=CC(=O)OS(=O)(=O)O1 |
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| InChI Key | OYYILCSSJZONRO-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 heteromonocyclic compounds |
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| Alternative Parents | carbonyl compoundshydrocarbon derivativesmonocarboxylic acids and derivativesorganic oxidesoxacyclic compounds |
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| Substituents | carbonyl groupcarboxylic acid derivativeoxacycleorganic oxidemonocarboxylic acid or derivativesorganic oxygen compoundsulfuric acid diesteraliphatic heteromonocyclic compoundhydrocarbon derivativeorganoheterocyclic compoundorganooxygen compound |
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