| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-20 23:40:34 UTC |
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| Update Date | 2025-03-21 17:58:46 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID00016624 |
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| Frequency | 256.7 |
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| Structure | |
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| Chemical Formula | C5H8O5S |
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| Molecular Mass | 180.0092 |
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| SMILES | CS(=O)(=O)CCC(=O)C(=O)O |
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| InChI Key | SJPDBCUMFYDCLK-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 acidsfatty acylshydrocarbon derivativesmonocarboxylic acids and derivativesorganic oxidessulfonesthia fatty acids |
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| Substituents | fatty acylaliphatic acyclic compoundcarbonyl groupcarboxylic acidshort-chain keto acidorganosulfur compoundalpha-hydroxy ketonecarboxylic acid derivativeketoneorganic oxidemonocarboxylic acid or derivativesthia fatty acidsulfonylorganic oxygen compoundalpha-keto acidhydrocarbon derivativeorganooxygen compoundsulfone |
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