| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 15:12:28 UTC |
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| Update Date | 2025-03-25 00:58:17 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02229781 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C8H17NO4S |
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| Molecular Mass | 223.0878 |
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| SMILES | CCCC(O)CCC(O)=NS(C)(=O)=O |
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| InChI Key | CJDICNIAEHXYLB-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 | organic sulfonic acids and derivatives |
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| Subclass | organosulfonic acids and derivatives |
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| Direct Parent | organosulfonic acids and derivatives |
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| Geometric Descriptor | aliphatic acyclic compounds |
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| Alternative Parents | hydrocarbon derivativesorganic oxidesorganonitrogen compoundsorganopnictogen compoundssecondary alcoholssulfonyls |
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| Substituents | alcoholaliphatic acyclic compoundorganosulfonic acid or derivativesorganosulfur compoundorganic oxidesulfonylorganic oxygen compoundorganonitrogen compoundsecondary alcoholorganopnictogen compoundhydrocarbon derivativeorganic nitrogen compoundorganooxygen compound |
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