| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 00:13:54 UTC |
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| Update Date | 2025-03-21 18:33:21 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID00095364 |
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| Frequency | 29.1 |
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| Structure | |
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| Chemical Formula | C4H11N3O3S |
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| Molecular Mass | 181.0521 |
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| SMILES | COS(=O)(=O)CCN=C(N)N |
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| InChI Key | VILLKRXPWIWQQF-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 | sulfonic acid esters |
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| Direct Parent | sulfonic acid esters |
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| Geometric Descriptor | aliphatic acyclic compounds |
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| Alternative Parents | carboximidamidesguanidineshydrocarbon derivativesorganic oxidesorganooxygen compoundsorganopnictogen compoundsorganosulfonic acid esterspropargyl-type 1,3-dipolar organic compoundssulfonyls |
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| Substituents | aliphatic acyclic compoundorganosulfonic acid or derivativesguanidineorganic 1,3-dipolar compoundcarboximidamideorganosulfur compoundorganosulfonic acid esterpropargyl-type 1,3-dipolar organic compoundsulfonic acid esterorganic oxidesulfonylorganic oxygen compoundorganonitrogen compoundorganopnictogen compoundhydrocarbon derivativeorganic nitrogen compoundorganooxygen compound |
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