| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-20 23:58:53 UTC |
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| Update Date | 2025-03-21 18:05:52 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID00059514 |
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| Frequency | 52.8 |
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| Structure | |
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| Chemical Formula | C4H9NO5S |
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| Molecular Mass | 183.0201 |
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| SMILES | NC(CCC(=O)O)S(=O)(=O)O |
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| InChI Key | KCBDKNCDPMQCTG-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 | carboxylic acids and derivatives |
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| Subclass | amino acids, peptides, and analogues |
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| Direct Parent | gamma amino acids and derivatives |
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| Geometric Descriptor | aliphatic acyclic compounds |
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| Alternative Parents | carbonyl compoundscarboxylic acidshydrocarbon derivativesmonoalkylaminesmonocarboxylic acids and derivativesorganic oxidesorganonitrogen compoundsorganopnictogen compoundsorganosulfonic acidsstraight chain fatty acidssulfonylsthia fatty acids |
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| Substituents | fatty acylaliphatic acyclic compoundorganosulfonic acid or derivativescarbonyl groupstraight chain fatty acidcarboxylic acidgamma amino acid or derivativesorganosulfonic acidfatty acidorganosulfur compoundorganic oxidemonocarboxylic acid or derivativesthia fatty acidsulfonylorganic oxygen compoundorganic sulfonic acid or derivativesorganonitrogen compoundorganopnictogen compoundhydrocarbon derivativeprimary aliphatic amineorganic nitrogen compoundorganooxygen compound |
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