| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 04:07:42 UTC |
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| Update Date | 2025-03-21 23:08:22 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID00645532 |
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| Frequency | 2.5 |
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| Structure | |
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| Chemical Formula | C6H6O2S |
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| Molecular Mass | 142.0088 |
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| SMILES | O=C(O)C1=CSC=CC1 |
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| InChI Key | ZZSROTOYJFSCMU-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 | thiopyrans |
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| Subclass | thiopyrans |
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| Direct Parent | thiopyrans |
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| Geometric Descriptor | aliphatic heteromonocyclic compounds |
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| Alternative Parents | carbonyl compoundscarboxylic acidshydrocarbon derivativesmonocarboxylic acids and derivativesorganic oxidesthioenol ethersvinylogous thioesters |
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| Substituents | vinylogous thioestercarbonyl groupcarboxylic acidthiopyrancarboxylic acid derivativeorganic oxidemonocarboxylic acid or derivativesthioenoletherorganic oxygen compoundaliphatic heteromonocyclic compoundhydrocarbon derivativeorganooxygen compound |
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