| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 00:06:24 UTC |
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| Update Date | 2025-03-21 18:29:27 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID00077545 |
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| Frequency | 37.8 |
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| Structure | |
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| Chemical Formula | C4H6O5S |
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| Molecular Mass | 165.9936 |
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| SMILES | O=C(O)C=CCS(=O)(=O)O |
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| InChI Key | HHHLEQNGCSZKJH-UHFFFAOYSA-N |
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| Chemical Taxonomy |
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| Kingdom | organic compounds |
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| Superclass | lipids and lipid-like molecules |
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| Class | fatty acyls |
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| Subclass | fatty acids and conjugates |
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| Direct Parent | thia fatty acids |
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| Geometric Descriptor | aliphatic acyclic compounds |
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| Alternative Parents | carbonyl compoundscarboxylic acidshydrocarbon derivativesmonocarboxylic acids and derivativesorganic oxidesorganosulfonic acidsstraight chain fatty acidssulfonylsunsaturated fatty acids |
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| Substituents | aliphatic acyclic compoundorganosulfonic acid or derivativescarbonyl groupstraight chain fatty acidcarboxylic acidorganosulfonic acidorganosulfur compoundcarboxylic acid derivativeunsaturated fatty acidorganic oxidemonocarboxylic acid or derivativesthia fatty acidsulfonylorganic oxygen compoundorganic sulfonic acid or derivativeshydrocarbon derivativeorganooxygen compound |
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