| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 12:51:29 UTC |
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| Update Date | 2025-03-24 21:48:42 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID01899120 |
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| Frequency | 0.6 |
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| Structure | |
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| Chemical Formula | C8H9NO |
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| Molecular Mass | 135.0684 |
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| SMILES | O=C1NC2C3C=CC(C3)C12 |
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| InChI Key | WBZQHVKGKQXWMW-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 compoundsazepanesazetidinesbeta lactamscarbonyl compoundscarboxylic acids and derivativeshydrocarbon derivativesorganic oxidesorganonitrogen compoundsorganopnictogen compoundssecondary carboxylic acid amides |
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| Substituents | caprolactamcarbonyl groupazacyclecarboxamide groupcarboxylic acid derivativeazetidinealiphatic heteropolycyclic compoundsecondary carboxylic acid amideorganic oxideazepaneorganic oxygen compoundorganonitrogen compoundorganopnictogen compoundhydrocarbon derivativeorganic nitrogen compoundbeta-lactamorganooxygen compound |
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