| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-20 23:59:54 UTC |
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| Update Date | 2025-03-21 18:06:14 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID00061999 |
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| Frequency | 50.1 |
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| Structure | |
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| Chemical Formula | C5H8O7S |
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| Molecular Mass | 211.9991 |
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| SMILES | O=C(O)CCC(C(=O)O)S(=O)(=O)O |
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| InChI Key | ZCXNPIWNNTXPSE-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 acidsdicarboxylic acids and derivativeshydrocarbon derivativesorganic oxidesorganosulfonic acidssulfonyls |
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| Substituents | aliphatic acyclic compoundorganosulfonic acid or derivativescarbonyl groupcarboxylic acidorganosulfonic acidorganosulfur compoundcarboxylic acid derivativeorganic oxidethia fatty acidsulfonylorganic oxygen compoundorganic sulfonic acid or derivativesdicarboxylic acid or derivativeshydrocarbon derivativeorganooxygen compound |
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