| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 14:49:24 UTC |
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| Update Date | 2025-03-25 00:49:51 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02177133 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C9H17NO2S2 |
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| Molecular Mass | 235.0701 |
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| SMILES | C=CCCS(=O)(=O)C(=S)N(CC)CC |
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| InChI Key | KXFVNTUDCDAINJ-UHFFFAOYSA-N |
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| Chemical Taxonomy |
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| Kingdom | organic compounds |
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| Superclass | organosulfur compounds |
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| Class | sulfonyls |
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| Subclass | sulfones |
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| Direct Parent | sulfones |
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| Geometric Descriptor | aliphatic acyclic compounds |
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| Alternative Parents | hydrocarbon derivativesorganic oxidesorganonitrogen compoundsorganopnictogen compounds |
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| Substituents | aliphatic acyclic compoundorganic oxideorganic oxygen compoundorganonitrogen compoundorganopnictogen compoundhydrocarbon derivativeorganic nitrogen compoundsulfone |
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