| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 15:15:40 UTC |
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| Update Date | 2025-03-25 00:59:26 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02237109 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C14H12O4S |
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| Molecular Mass | 276.0456 |
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| SMILES | O=C(OS(=O)(=O)Cc1ccccc1)c1ccccc1 |
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| InChI Key | HZOSFFCCMRGWRC-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 and derivatives |
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| Geometric Descriptor | aromatic homomonocyclic compounds |
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| Alternative Parents | benzoyl derivativeshydrocarbon derivativesmonocarboxylic acids and derivativesorganic oxidesorganooxygen compoundsorganosulfonic acids and derivativessulfonyls |
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| Substituents | organosulfonic acid or derivativesbenzoylbenzoic acid or derivativesorganosulfur compoundcarboxylic acid derivativearomatic homomonocyclic compoundorganic oxidemonocarboxylic acid or derivativessulfonylorganic oxygen compoundorganic sulfonic acid or derivativeshydrocarbon derivativeorganooxygen compound |
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