| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 00:40:55 UTC |
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| Update Date | 2025-03-21 18:48:25 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID00159449 |
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| Frequency | 28.6 |
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| Structure | |
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| Chemical Formula | C4H7NO6S |
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| Molecular Mass | 196.9994 |
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| SMILES | O=C(O)CCC(O)=NS(=O)(=O)O |
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| InChI Key | SQGFFMSCLJLAIP-UHFFFAOYSA-N |
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| Chemical Taxonomy |
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| Kingdom | organic compounds |
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| Superclass | organic acids and derivatives |
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| Class | hydroxy acids and derivatives |
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| Subclass | short-chain hydroxy acids and derivatives |
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| Direct Parent | short-chain hydroxy acids and derivatives |
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| Geometric Descriptor | aliphatic acyclic compounds |
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| Alternative Parents | carbonyl compoundscarboxylic acidshydrocarbon derivativesmonocarboxylic acids and derivativesorganic oxidesorganic sulfuric acids and derivativesorganonitrogen compoundsorganopnictogen compoundsstraight chain fatty acids |
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| Substituents | fatty acylaliphatic acyclic compoundcarbonyl groupstraight chain fatty acidcarboxylic acidorganic sulfuric acid or derivativesshort-chain hydroxy acidfatty acidcarboxylic acid derivativeorganic oxidemonocarboxylic acid or derivativesorganic oxygen compoundorganonitrogen compoundorganopnictogen compoundhydrocarbon derivativeorganic nitrogen compoundorganooxygen compound |
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