| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 00:19:21 UTC |
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| Update Date | 2025-03-21 18:36:04 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID00108774 |
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| Frequency | 24.6 |
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| Structure | |
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| Chemical Formula | C10H19NO3S3 |
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| Molecular Mass | 297.0527 |
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| SMILES | CC(CSC(=S)NCCCCS(C)=O)C(=O)O |
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| InChI Key | LEMJPBUNQNYTOH-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 acidshydrocarbon derivativesmonocarboxylic acids and derivativesorganic oxidesorganonitrogen compoundsorganopnictogen compoundssulfenyl compoundssulfinyl compoundssulfoxides |
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| Substituents | aliphatic acyclic compoundcarbonyl groupcarboxylic acidsulfenyl compoundorganosulfur compoundcarboxylic acid derivativedithiocarbamic acid esterorganic oxidemonocarboxylic acid or derivativesorganic oxygen compoundsulfinyl compoundorganonitrogen compoundsulfoxideorganopnictogen compoundhydrocarbon derivativeorganic nitrogen compoundorganooxygen compound |
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