| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 11:18:30 UTC |
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| Update Date | 2025-03-24 21:07:16 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID01678456 |
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| Frequency | 0.7 |
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| Structure | |
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| Chemical Formula | C8H13NO |
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| Molecular Mass | 139.0997 |
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| SMILES | CN1C(=O)C2CCCC1C2 |
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| InChI Key | HERJPLYJVGTFDX-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 compoundsazepanescarbonyl 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 derivativealiphatic heteropolycyclic compoundorganic oxideazepaneorganic oxygen compoundtertiary carboxylic acid amideorganonitrogen compoundorganopnictogen compoundhydrocarbon derivativeorganic nitrogen compoundpyrrolidinepyrrolidoneorganooxygen compound |
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