| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 09:45:22 UTC |
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| Update Date | 2025-03-24 20:27:46 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID01454792 |
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| Frequency | 0.9 |
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| Structure | |
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| Chemical Formula | C5H5NOS |
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| Molecular Mass | 127.0092 |
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| SMILES | O=C1NC2SC=CC12 |
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| InChI Key | BQPQZYCVDSEAGK-UHFFFAOYSA-N |
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| Chemical Taxonomy |
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| Kingdom | organic compounds |
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| Superclass | organoheterocyclic compounds |
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| Class | dihydrothiophenes |
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| Subclass | dihydrothiophenes |
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| Direct Parent | dihydrothiophenes |
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| Geometric Descriptor | aliphatic heteropolycyclic compounds |
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| Alternative Parents | azacyclic compoundsazetidinesbeta lactamscarbonyl compoundscarboxylic acids and derivativeshydrocarbon derivativesorganic oxidesorganonitrogen compoundsorganopnictogen compoundssecondary carboxylic acid amidesthioenol ethersthiohemiaminal derivatives |
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| Substituents | carbonyl grouplactamazacycle2,3-dihydrothiophenecarboxamide groupcarboxylic acid derivativeazetidinealiphatic heteropolycyclic compoundsecondary carboxylic acid amideorganic oxidethioenoletherorganic oxygen compoundorganonitrogen compoundhemithioaminalorganopnictogen compoundhydrocarbon derivativeorganic nitrogen compoundbeta-lactamorganooxygen compound |
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