| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 00:25:40 UTC |
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| Update Date | 2025-03-21 18:39:04 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID00123852 |
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| Frequency | 20.8 |
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| Structure | |
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| Chemical Formula | C8H16N2O2S3 |
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| Molecular Mass | 268.0374 |
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| SMILES | CS(=O)CCCCNC(=S)SCC(N)=O |
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| InChI Key | KUOOOYIHSFPPHC-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 | dithiocarbamic acids and derivatives |
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| Subclass | dithiocarbamic acid esters |
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| Direct Parent | dithiocarbamic acid esters |
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| Geometric Descriptor | aliphatic acyclic compounds |
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| Alternative Parents | carbonyl compoundscarboxylic acids and derivativeshydrocarbon derivativesorganic oxidesorganonitrogen compoundsorganopnictogen compoundsprimary carboxylic acid amidessulfenyl compoundssulfinyl compoundssulfoxides |
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| Substituents | primary carboxylic acid amidealiphatic acyclic compoundcarbonyl groupsulfenyl compoundorganosulfur compoundcarboxamide groupcarboxylic acid derivativedithiocarbamic acid esterorganic oxideorganic oxygen compoundsulfinyl compoundorganonitrogen compoundsulfoxideorganopnictogen compoundhydrocarbon derivativeorganic nitrogen compoundorganooxygen compound |
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