| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 15:00:23 UTC |
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| Update Date | 2025-03-25 00:53:49 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02202143 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C12H20NOS+ |
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| Molecular Mass | 226.126 |
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| SMILES | CSC(Cc1ccc(O)cc1)[N+](C)(C)C |
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| InChI Key | VPBCICAOCSFMEH-UHFFFAOYSA-O |
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| Chemical Taxonomy |
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| Kingdom | organic compounds |
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| Superclass | benzenoids |
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| Class | phenols |
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| Subclass | 1-hydroxy-2-unsubstituted benzenoids |
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| Direct Parent | 1-hydroxy-2-unsubstituted benzenoids |
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| Geometric Descriptor | aromatic homomonocyclic compounds |
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| Alternative Parents | benzene and substituted derivativesdialkylthioethershydrocarbon derivativesorganic cationsorganic saltsorganonitrogen compoundsorganooxygen compoundsorganopnictogen compoundssulfenyl compoundstetraalkylammonium salts |
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| Substituents | monocyclic benzene moietysulfenyl compoundtetraalkylammonium saltdialkylthioether1-hydroxy-2-unsubstituted benzenoidorganosulfur compoundaromatic homomonocyclic compoundorganic oxygen compoundthioetherorganonitrogen compoundorganopnictogen compoundhydrocarbon derivativeorganic nitrogen compoundorganic cationorganic saltorganooxygen compound |
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