| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 12:42:14 UTC |
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| Update Date | 2025-03-24 21:44:50 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID01877527 |
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| Frequency | 0.6 |
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| Structure | |
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| Chemical Formula | C7H9NO2 |
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| Molecular Mass | 139.0633 |
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| SMILES | O=C1NC2C=CC1C(O)C2 |
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| InChI Key | QKSHOOTYJRWLNZ-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 | piperidines |
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| Subclass | piperidinones |
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| Direct Parent | piperidinones |
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| Geometric Descriptor | aliphatic heteropolycyclic compounds |
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| Alternative Parents | azacyclic compoundscarbonyl compoundscarboxylic acids and derivativesdelta lactamshydrocarbon derivativesorganic oxidesorganonitrogen compoundsorganopnictogen compoundssecondary alcoholssecondary carboxylic acid amides |
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| Substituents | alcoholcarbonyl grouplactamazacyclecarboxamide groupcarboxylic acid derivativedelta-lactamaliphatic heteropolycyclic compoundsecondary carboxylic acid amideorganic oxideorganic oxygen compoundorganonitrogen compoundsecondary alcoholorganopnictogen compoundpiperidinonehydrocarbon derivativeorganic nitrogen compoundorganooxygen compound |
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