| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 14:47:13 UTC |
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| Update Date | 2025-03-25 00:49:07 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02172096 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C11H13NS |
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| Molecular Mass | 191.0769 |
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| SMILES | CN1CC2Sc3ccccc3C2C1 |
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| InChI Key | QSYLQJDWFIZDST-UHFFFAOYSA-N |
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| Chemical Taxonomy |
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| Kingdom | organic compounds |
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| Superclass | organosulfur compounds |
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| Class | thioethers |
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| Subclass | aryl thioethers |
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| Direct Parent | aryl thioethers |
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| Geometric Descriptor | aromatic heteropolycyclic compounds |
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| Alternative Parents | alkylarylthioethersazacyclic compoundsbenzenoidshydrocarbon derivativesn-alkylpyrrolidinesorganopnictogen compoundstrialkylamines |
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| Substituents | azacyclen-alkylpyrrolidinetertiary aliphatic aminealkylarylthioetheraryl thioetheraromatic heteropolycyclic compoundorganonitrogen compoundorganopnictogen compoundhydrocarbon derivativebenzenoidorganic nitrogen compoundpyrrolidineaminetertiary amineorganoheterocyclic compound |
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