| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 15:20:07 UTC |
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| Update Date | 2025-03-25 01:01:10 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02247412 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C11H22N2O3S3 |
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| Molecular Mass | 326.0793 |
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| SMILES | CS(=O)CCCCNC(=S)NCCSCCC(=O)O |
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| InChI Key | DAPFVJPAAVPNIA-UHFFFAOYSA-N |
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| Chemical Taxonomy |
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| Kingdom | organic compounds |
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| Superclass | organosulfur compounds |
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| Class | thioureas |
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| Subclass | thioureas |
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| Direct Parent | thioureas |
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| Geometric Descriptor | aliphatic acyclic compounds |
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| Alternative Parents | carbonyl compoundscarboxylic acidsdialkylthioethershydrocarbon derivativesmonocarboxylic acids and derivativesorganic oxidesorganonitrogen compoundsorganopnictogen compoundssulfenyl compoundssulfinyl compoundssulfoxides |
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| Substituents | aliphatic acyclic compoundcarbonyl groupthioureacarboxylic acidsulfenyl compounddialkylthioethercarboxylic acid derivativeorganic oxidemonocarboxylic acid or derivativesorganic oxygen compoundsulfinyl compoundthioetherorganonitrogen compoundsulfoxideorganopnictogen compoundhydrocarbon derivativeorganic nitrogen compoundorganooxygen compound |
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