Record Information |
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HMDB Status | Not Available |
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Creation Date | 2024-02-21 05:16:12 UTC |
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Update Date | 2025-03-24 14:15:15 UTC |
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HMDB ID | Not Available |
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Metabolite Identification |
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DeepMet ID | DMID00809110 |
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Frequency | 1.8 |
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Structure | |
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Chemical Formula | C4H6O2S |
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Molecular Mass | 118.0088 |
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SMILES | CSC(=O)CC=O |
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InChI Key | LBMLQXZFSLFSBF-UHFFFAOYSA-N |
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Chemical Taxonomy |
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Kingdom | organic compounds |
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Superclass | organic oxygen compounds |
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Class | organooxygen compounds |
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Subclass | carbonyl compounds |
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Direct Parent | alpha-hydrogen aldehydes |
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Geometric Descriptor | aliphatic acyclic compounds |
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Alternative Parents | carbothioic s-esterscarboxylic acids and derivativeshydrocarbon derivativesorganic oxidessulfenyl compoundsthioestersthiolactones |
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Substituents | aliphatic acyclic compoundthiocarboxylic acid or derivativessulfenyl compoundthiocarboxylic acid esterorganosulfur compoundcarboxylic acid derivativecarbothioic s-esterorganic oxidealpha-hydrogen aldehydehydrocarbon derivativethiolactone |
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