| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 00:21:24 UTC |
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| Update Date | 2025-03-21 18:37:03 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID00113753 |
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| Frequency | 23.3 |
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| Structure | |
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| Chemical Formula | C9H10N2O2 |
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| Molecular Mass | 178.0742 |
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| SMILES | CN1C(=O)CC1c1ccc[n+]([O-])c1 |
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| InChI Key | IFKRBTPNIHTILK-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 | beta lactams |
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| Direct Parent | monobactams |
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| Geometric Descriptor | aromatic heteromonocyclic compounds |
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| Alternative Parents | azacyclic compoundsazetidinescarbonyl compoundscarboxylic acids and derivativesheteroaromatic compoundshydrocarbon derivativesmethylpyridinesorganic oxidesorganonitrogen compoundsorganopnictogen compoundstertiary carboxylic acid amides |
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| Substituents | carbonyl grouparomatic heteromonocyclic compoundazacycleheteroaromatic compoundmonobactammethylpyridinecarboxamide groupcarboxylic acid derivativeazetidineorganic oxidepyridineorganic oxygen compoundtertiary carboxylic acid amideorganonitrogen compoundorganopnictogen compoundhydrocarbon derivativeorganic nitrogen compoundorganooxygen compound |
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