| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-20 23:51:43 UTC |
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| Update Date | 2025-03-21 18:03:10 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID00042630 |
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| Frequency | 80.1 |
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| Structure | |
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| Chemical Formula | C8H8O5S |
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| Molecular Mass | 216.0092 |
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| SMILES | CS(=O)(=O)Oc1ccc(C(=O)O)cc1 |
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| InChI Key | UVKXRNHMWWUFDS-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 | benzoic acids and derivatives |
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| Direct Parent | benzoic acids |
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| Geometric Descriptor | aromatic homomonocyclic compounds |
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| Alternative Parents | benzoyl derivativescarboxylic acidshydrocarbon derivativesmethanesulfonatesmonocarboxylic acids and derivativesorganic oxidesorganooxygen compoundsorganosulfonic acid estersphenoxy compoundssulfonic acid esterssulfonyls |
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| Substituents | organosulfonic acid or derivativescarboxylic acidbenzoylorganosulfur compoundcarboxylic acid derivativeorganosulfonic acid esteraromatic homomonocyclic compoundsulfonic acid estermethanesulfonateorganic oxidemonocarboxylic acid or derivativessulfonylorganic oxygen compoundorganic sulfonic acid or derivativeshydrocarbon derivativebenzoic acidphenoxy compoundorganooxygen compound |
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