Record Information |
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HMDB Status | Not Available |
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Creation Date | 2024-02-21 01:20:16 UTC |
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Update Date | 2025-03-21 19:11:43 UTC |
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HMDB ID | Not Available |
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Metabolite Identification |
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DeepMet ID | DMID00251469 |
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Frequency | 8.3 |
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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 | CSC(C)C(N)=O |
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InChI Key | PBQKWXUCMGTHNU-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 | carboxylic acids and derivatives |
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Subclass | carboxylic acid derivatives |
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Direct Parent | primary carboxylic acid amides |
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Geometric Descriptor | aliphatic acyclic compounds |
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Alternative Parents | carbonyl compoundscarboxylic acids and derivativesdialkylthioethershydrocarbon derivativesorganic oxidesorganonitrogen compoundsorganopnictogen compoundssulfenyl compounds |
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Substituents | primary carboxylic acid amidealiphatic acyclic compoundcarbonyl groupsulfenyl compounddialkylthioetherorganosulfur compoundorganic oxideorganic oxygen compoundthioetherorganonitrogen compoundorganopnictogen compoundhydrocarbon derivativeorganic nitrogen compoundorganooxygen compound |
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