Record Information |
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HMDB Status | Not Available |
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Creation Date | 2024-02-21 07:09:01 UTC |
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Update Date | 2025-03-24 19:55:25 UTC |
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HMDB ID | Not Available |
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Metabolite Identification |
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DeepMet ID | DMID01078764 |
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Frequency | 1.3 |
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Structure | |
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Chemical Formula | C6H9NO |
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Molecular Mass | 111.0684 |
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SMILES | O=C1CCC2CCN12 |
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InChI Key | AGZLGRYFDGIVTG-UHFFFAOYSA-N |
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Chemical Taxonomy |
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Kingdom | organic compounds |
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Superclass | organoheterocyclic compounds |
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Class | lactams |
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Subclass | caprolactams |
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Direct Parent | caprolactams |
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Geometric Descriptor | aliphatic heteropolycyclic compounds |
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Alternative Parents | azacyclic compoundsazepanesazetidinescarbonyl compoundscarboxylic acids and derivativeshydrocarbon derivativesn-alkylpyrrolidinesorganic oxidesorganonitrogen compoundsorganopnictogen compoundspyrrolidine-2-onestertiary carboxylic acid amides |
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Substituents | 2-pyrrolidonecaprolactamcarbonyl groupazacyclen-alkylpyrrolidinecarboxamide groupcarboxylic acid derivativeazetidinealiphatic heteropolycyclic compoundorganic oxideazepaneorganic oxygen compoundtertiary carboxylic acid amideorganonitrogen compoundorganopnictogen compoundhydrocarbon derivativeorganic nitrogen compoundpyrrolidinepyrrolidoneorganooxygen compound |
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