| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 04:07:16 UTC |
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| Update Date | 2025-03-21 23:08:07 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID00644491 |
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| Frequency | 2.5 |
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| Structure | |
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| Chemical Formula | C6H9NOS |
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| Molecular Mass | 143.0405 |
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| SMILES | CSC1=C(C)C(=O)NC1 |
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| InChI Key | FTNDHCRMKWOLLA-UHFFFAOYSA-N |
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| Chemical Taxonomy |
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| Kingdom | organic compounds |
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| Superclass | organic acids and derivatives |
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| Class | vinylogous thioesters |
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| Subclass | vinylogous thioesters |
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| Direct Parent | vinylogous thioesters |
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| Geometric Descriptor | aliphatic heteromonocyclic compounds |
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| Alternative Parents | azacyclic compoundscarbonyl compoundscarboxylic acids and derivativeshydrocarbon derivativeslactamsorganic oxidesorganonitrogen compoundsorganopnictogen compoundspyrrolinessecondary carboxylic acid amidessulfenyl compoundsthioenol ethers |
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| Substituents | vinylogous thioestercarbonyl grouplactamsulfenyl compoundazacycleorganosulfur compoundcarboxamide groupcarboxylic acid derivativesecondary carboxylic acid amideorganic oxidethioenoletherorganic oxygen compoundpyrrolinealiphatic heteromonocyclic compoundorganonitrogen compoundorganopnictogen compoundhydrocarbon derivativeorganic nitrogen compoundorganoheterocyclic compoundorganooxygen compound |
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