| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 15:10:11 UTC |
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| Update Date | 2025-03-25 00:57:27 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02224857 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C6H13NOS2 |
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| Molecular Mass | 179.0439 |
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| SMILES | NCCSCCC(=O)CS |
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| InChI Key | CSOCKOWELNTWGL-UHFFFAOYSA-N |
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| Chemical Taxonomy |
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| Kingdom | organic compounds |
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| Superclass | organic oxygen compounds |
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| Class | organooxygen compounds |
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| Subclass | carbonyl compounds |
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| Direct Parent | ketones |
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| Geometric Descriptor | aliphatic acyclic compounds |
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| Alternative Parents | alkylthiolsdialkylthioethershydrocarbon derivativesmonoalkylaminesorganic oxidesorganonitrogen compoundsorganopnictogen compoundssulfenyl compounds |
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| Substituents | aliphatic acyclic compoundsulfenyl compounddialkylthioetherorganosulfur compoundketoneorganic oxidethioetherorganonitrogen compoundorganopnictogen compoundhydrocarbon derivativeprimary aliphatic amineorganic nitrogen compoundalkylthiol |
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