| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 00:11:34 UTC |
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| Update Date | 2025-03-21 18:32:12 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID00089713 |
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| Frequency | 31.5 |
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| Structure | |
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| Chemical Formula | C7H11NOS2 |
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| Molecular Mass | 189.0282 |
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| SMILES | C=CCNC(=S)SCC(C)=O |
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| InChI Key | SDPNTUJRDAVPOJ-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 derivativesketonesorganic oxidesorganonitrogen compoundsorganopnictogen compoundssulfenyl compounds |
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| Substituents | aliphatic acyclic compoundcarbonyl groupsulfenyl compoundorganosulfur compoundketonedithiocarbamic acid esterorganic oxideorganic oxygen compoundorganonitrogen compoundorganopnictogen compoundhydrocarbon derivativeorganic nitrogen compoundorganooxygen compound |
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