| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-20 23:59:40 UTC |
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| Update Date | 2025-03-21 18:06:09 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID00061426 |
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| Frequency | 50.7 |
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| Structure | |
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| Chemical Formula | C5H12N2O2S |
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| Molecular Mass | 164.0619 |
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| SMILES | NC(CS)C(=O)NCCO |
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| InChI Key | OLUGPPHWEUTWCY-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 | amino acids, peptides, and analogues |
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| Direct Parent | alpha amino acid amides |
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| Geometric Descriptor | aliphatic acyclic compounds |
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| Alternative Parents | alcohols and polyolsalkanolaminesalkylthiolsalpha amino acidscarbonyl compoundscarboxylic acids and derivativescysteine and derivativeshydrocarbon derivativesmonoalkylaminesn-acylethanolaminesorganic oxidesorganonitrogen compoundsorganopnictogen compoundsorganosulfur compoundssecondary carboxylic acid amides |
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| Substituents | alcoholaliphatic acyclic compoundcarbonyl groupalpha-amino acid amideorganosulfur compoundcarboxamide groupn-acylethanolaminesecondary carboxylic acid amideorganic oxideorganic oxygen compoundcysteine or derivativesorganonitrogen compoundalpha-amino acidorganopnictogen compoundhydrocarbon derivativeprimary aliphatic amineorganic nitrogen compoundalkylthiolorganooxygen compoundalkanolamine |
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