| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 15:21:07 UTC |
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| Update Date | 2025-03-25 01:01:29 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02249669 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C14H15NO2S |
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| Molecular Mass | 261.0824 |
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| SMILES | Cc1ccc(-c2ccc(CS(N)(=O)=O)cc2)cc1 |
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| InChI Key | WPIYLIVTACUHFC-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 | toluenes |
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| Direct Parent | toluenes |
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| Geometric Descriptor | aromatic homomonocyclic compounds |
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| Alternative Parents | aminosulfonyl compoundshydrocarbon derivativesorganic nitrogen compoundsorganic oxidesorganic sulfonamidesorganosulfonamides |
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| Substituents | organosulfonic acid or derivativesaminosulfonyl compoundorganosulfur compoundorganosulfonic acid amidearomatic homomonocyclic compoundorganic oxidesulfonylorganic oxygen compoundorganic sulfonic acid or derivativeshydrocarbon derivativeorganic nitrogen compoundorganic sulfonic acid amidetoluene |
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