| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 00:31:09 UTC |
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| Update Date | 2025-03-21 18:41:53 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID00136679 |
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| Frequency | 18.3 |
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| Structure | |
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| Chemical Formula | C8H18N2OS3 |
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| Molecular Mass | 254.0581 |
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| SMILES | CS(=O)CCCCNC(=S)SCCN |
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| InChI Key | LDLOZHOEFQWVLJ-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 | hydrocarbon derivativesmonoalkylaminesorganic oxidesorganonitrogen compoundsorganopnictogen compoundssulfenyl compoundssulfinyl compoundssulfoxides |
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| Substituents | aliphatic acyclic compoundsulfenyl compoundorganosulfur compounddithiocarbamic acid esterorganic oxideorganic oxygen compoundsulfinyl compoundorganonitrogen compoundsulfoxideorganopnictogen compoundhydrocarbon derivativeprimary aliphatic amineorganic nitrogen compound |
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