| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-20 23:38:22 UTC |
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| Update Date | 2025-03-21 17:58:01 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID00011700 |
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| Frequency | 393.5 |
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| Structure | |
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| Chemical Formula | C4H6O8S |
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| Molecular Mass | 213.9783 |
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| SMILES | O=C(CC(O)C(=O)O)OS(=O)(=O)O |
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| InChI Key | GLBYZGAUNIWLOX-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 | beta hydroxy acids and derivatives |
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| Direct Parent | beta hydroxy acids and derivatives |
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| Geometric Descriptor | aliphatic acyclic compounds |
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| Alternative Parents | alpha hydroxy acids and derivativescarbonyl compoundscarboxylic acidsdicarboxylic acids and derivativeshydrocarbon derivativeshydroxy fatty acidsorganic oxidessecondary alcoholsshort-chain hydroxy acids and derivativessulfuric acid monoesters |
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| Substituents | alcoholfatty acylaliphatic acyclic compoundsulfuric acid monoestercarbonyl groupcarboxylic acidorganic sulfuric acid or derivativesshort-chain hydroxy acidalpha-hydroxy acidfatty acidcarboxylic acid derivativebeta-hydroxy acidorganic oxideorganic oxygen compoundsecondary alcoholdicarboxylic acid or derivativeshydrocarbon derivativehydroxy fatty acidsulfuric acid esterorganooxygen compound |
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