| Record Information |
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| HMDB Status | quantified |
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| Creation Date | 2024-02-20 23:34:01 UTC |
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| Update Date | 2025-03-21 17:56:28 UTC |
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| HMDB ID | HMDB0001553 |
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| Metabolite Identification |
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| DeepMet ID | DMID00001526 |
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| Name | 2-Oxo-4-methylthiobutanoic acid |
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| Frequency | 3868.6 |
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| Structure | |
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| Chemical Formula | C5H8O3S |
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| Molecular Mass | 148.0194 |
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| SMILES | CSCCC(=O)C(=O)O |
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| InChI Key | SXFSQZDSUWACKX-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 | keto acids and derivatives |
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| Subclass | short-chain keto acids and derivatives |
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| Direct Parent | short-chain keto acids and derivatives |
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| Geometric Descriptor | aliphatic acyclic compounds |
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| Alternative Parents | alpha-hydroxy ketonesalpha-keto acids and derivativescarboxylic acidsdialkylthioethersfatty acylshydrocarbon derivativesmonocarboxylic acids and derivativesorganic oxidessulfenyl compoundsthia fatty acids |
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| Substituents | fatty acylaliphatic acyclic compoundcarbonyl groupcarboxylic acidsulfenyl compounddialkylthioethershort-chain keto acidorganosulfur compoundalpha-hydroxy ketonecarboxylic acid derivativeketoneorganic oxidemonocarboxylic acid or derivativesthia fatty acidorganic oxygen compoundthioetheralpha-keto acidhydrocarbon derivativeorganooxygen compound |
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