| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 00:49:24 UTC |
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| Update Date | 2025-03-21 18:51:22 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID00179871 |
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| Frequency | 12.8 |
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| Structure | |
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| Chemical Formula | C7H9NS |
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| Molecular Mass | 139.0456 |
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| SMILES | CSc1ccccc1N |
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| InChI Key | WBRPQQSADOCKCH-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 | thiophenols |
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| Subclass | thiophenols |
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| Direct Parent | thiophenols |
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| Geometric Descriptor | aromatic homomonocyclic compounds |
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| Alternative Parents | alkylarylthioethersbenzene and substituted derivativeshydrocarbon derivativesorganopnictogen compoundsprimary aminessulfenyl compoundsthiophenol ethers |
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| Substituents | monocyclic benzene moietysulfenyl compoundalkylarylthioetherorganosulfur compoundaryl thioetheraromatic homomonocyclic compoundthiophenolthioetherthiophenol etherorganonitrogen compoundorganopnictogen compoundhydrocarbon derivativeprimary amineorganic nitrogen compoundamine |
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