| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 14:51:45 UTC |
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| Update Date | 2025-03-25 00:50:41 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02182496 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C7H6O4S |
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| Molecular Mass | 185.9987 |
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| SMILES | O=CS(=O)(=O)Oc1ccccc1 |
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| InChI Key | SMNPQHDTOZVPGO-UHFFFAOYSA-N |
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| Chemical Taxonomy |
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| Kingdom | organic compounds |
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| Superclass | benzenoids |
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| Class | benzene and substituted derivatives |
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| Subclass | phenoxy compounds |
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| Direct Parent | phenoxy compounds |
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| Geometric Descriptor | aromatic homomonocyclic compounds |
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| Alternative Parents | acylsulfonic acids and derivativescarbonyl compoundscarboxylic acids and derivativeshydrocarbon derivativesorganic oxidessulfonic acid esterssulfonylsthiolactones |
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| Substituents | carbonyl groupacylsulfonic acid or derivativesorganosulfur compoundcarboxylic acid derivativearomatic homomonocyclic compoundsulfonic acid esterorganic oxidesulfonylorganic oxygen compoundorganic sulfonic acid or derivativeshydrocarbon derivativephenoxy compoundthiolactoneorganooxygen compound |
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