| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 11:49:09 UTC |
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| Update Date | 2025-03-24 21:21:31 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID01752204 |
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| Frequency | 0.7 |
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| Structure | |
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| Chemical Formula | C3H5NO3S |
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| Molecular Mass | 134.999 |
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| SMILES | CC(C#N)S(=O)(=O)O |
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| InChI Key | DFFQJBTUPDTVGO-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 |
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| Geometric Descriptor | aliphatic acyclic compounds |
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| Alternative Parents | hydrocarbon derivativesnitrilesorganic oxidesorganonitrogen compoundsorganopnictogen compoundssulfonyls |
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| Substituents | aliphatic acyclic compoundnitrileorganosulfonic acidorganosulfur compoundorganic oxidesulfonylorganic oxygen compoundorganonitrogen compoundorganopnictogen compoundhydrocarbon derivativeorganic nitrogen compoundcarbonitrile |
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