Record Information |
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HMDB Status | Not Available |
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Creation Date | 2024-02-21 08:01:25 UTC |
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Update Date | 2025-03-24 22:28:03 UTC |
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HMDB ID | Not Available |
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Metabolite Identification |
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DeepMet ID | DMID01206174 |
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Frequency | 1.1 |
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Structure | |
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Chemical Formula | C4H9NOS |
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Molecular Mass | 119.0405 |
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SMILES | CC(CN)C(O)=S |
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InChI Key | ALAZFSGSMARJIX-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 | carbodithioic acids |
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Subclass | carbodithioic acids |
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Direct Parent | carbodithioic acids |
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Geometric Descriptor | aliphatic acyclic compounds |
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Alternative Parents | carbonyl compoundscarbothioic o-acidshydrocarbon derivativesmonoalkylaminesorganonitrogen compoundsorganopnictogen compoundsthiocarbonyl compoundsthiocarboxylic acids and derivatives |
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Substituents | aliphatic acyclic compoundthiocarboxylic acid or derivativescarbonyl groupthiocarbonyl groupcarbodithioic acidorganosulfur compoundorganic oxygen compoundcarbothioic o-acidorganonitrogen compoundorganopnictogen compoundhydrocarbon derivativeprimary aliphatic amineorganic nitrogen compoundorganooxygen compound |
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