| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 14:38:52 UTC |
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| Update Date | 2025-03-25 00:46:05 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02153161 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C5H8N2O5S |
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| Molecular Mass | 208.0154 |
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| SMILES | NC(=O)C1CCC(=O)N1S(=O)(=O)O |
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| InChI Key | QTJZTBJYBZEYHQ-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 | proline and derivatives |
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| Geometric Descriptor | aliphatic heteromonocyclic compounds |
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| Alternative Parents | alpha amino acid amidesalpha amino acidsazacyclic compoundscarbonyl compoundscarboxylic acids and derivativeshydrocarbon derivativesorganic oxidesorganic sulfuric acids and derivativesorganonitrogen compoundsorganopnictogen compoundsprimary carboxylic acid amidespyrrolidine-2-onespyrrolidinecarboxamides |
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| Substituents | primary carboxylic acid amide2-pyrrolidonecarbonyl grouporganic oxidealiphatic heteromonocyclic compoundorganonitrogen compoundalpha-amino acidorganopnictogen compoundpyrrolidinepyrrolidoneorganoheterocyclic compoundproline or derivativesorganic sulfuric acid or derivativesalpha-amino acid amideazacyclecarboxamide grouppyrrolidine carboxylic acid or derivativesorganic oxygen compoundhydrocarbon derivativeorganic nitrogen compoundpyrrolidine-2-carboxamideorganooxygen compound |
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