| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-20 23:50:33 UTC |
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| Update Date | 2025-03-21 18:02:43 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID00039807 |
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| Frequency | 87.2 |
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| Structure | |
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| Chemical Formula | C9H13NO2S |
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| Molecular Mass | 199.0667 |
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| SMILES | Cc1cccc(C)c1NS(C)(=O)=O |
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| InChI Key | CLMPXVSJALKBTQ-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 | sulfanilides |
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| Direct Parent | sulfanilides |
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| Geometric Descriptor | aromatic homomonocyclic compounds |
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| Alternative Parents | aminosulfonyl compoundshydrocarbon derivativesorganic oxidesorganic sulfonamidesorganonitrogen compoundsorganopnictogen compoundsorganosulfonamidesm-xylenes |
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| Substituents | organosulfonic acid or derivativesaminosulfonyl compoundm-xyleneorganosulfur compoundorganosulfonic acid amidearomatic homomonocyclic compoundxylenesulfanilideorganic oxidesulfonylorganic oxygen compoundorganic sulfonic acid or derivativesorganonitrogen compoundorganopnictogen compoundhydrocarbon derivativeorganic nitrogen compoundorganic sulfonic acid amide |
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