| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 15:13:48 UTC |
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| Update Date | 2025-03-25 00:58:47 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02232818 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C5H8O3S |
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| Molecular Mass | 148.0194 |
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| SMILES | CC=CC(=O)S(C)(=O)=O |
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| InChI Key | IIZBWGBHVLRZSG-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 | sulfonyls |
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| Subclass | sulfones |
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| Direct Parent | sulfones |
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| Geometric Descriptor | aliphatic acyclic compounds |
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| Alternative Parents | carbonyl compoundscarboxylic acids and derivativeshydrocarbon derivativesorganic oxidesthiolactones |
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| Substituents | aliphatic acyclic compoundcarbonyl grouporganic oxideorganic oxygen compoundhydrocarbon derivativecarboxylic acid derivativethiolactoneorganooxygen compoundsulfone |
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