| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 00:07:27 UTC |
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| Update Date | 2025-03-21 18:29:54 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID00080086 |
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| Frequency | 36.3 |
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| Structure | |
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| Chemical Formula | C7H8O7S |
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| Molecular Mass | 235.9991 |
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| SMILES | CC(O)C1=CC(=O)C(O)=C1OS(=O)(=O)O |
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| InChI Key | RTOUPRQOLHFLEY-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 homomonocyclic compounds |
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| Alternative Parents | cyclic ketoneshydrocarbon derivativesorganic oxidessecondary alcohols |
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| Substituents | alcoholsulfuric acid monoestercarbonyl groupcyclic ketoneketoneorganic oxideorganic oxygen compoundsecondary alcoholaliphatic homomonocyclic compoundsulfate-esterhydrocarbon derivativeorganooxygen compound |
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