| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 00:14:34 UTC |
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| Update Date | 2025-03-21 18:33:40 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID00097007 |
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| Frequency | 28.5 |
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| Structure | |
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| Chemical Formula | C10H12N2O2 |
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| Molecular Mass | 192.0899 |
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| SMILES | O=CN1CCCC1c1ccc[n+]([O-])c1 |
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| InChI Key | HVKYWBBTQJMVMD-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 | pyridines and derivatives |
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| Subclass | pyrrolidinylpyridines |
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| Direct Parent | pyrrolidinylpyridines |
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| Geometric Descriptor | aromatic heteromonocyclic compounds |
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| Alternative Parents | alkaloids and derivativesazacyclic compoundscarbonyl compoundscarboxylic acids and derivativesheteroaromatic compoundshydrocarbon derivativesorganic oxidesorganonitrogen compoundsorganopnictogen compoundspyrrolidinestertiary carboxylic acid amides |
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| Substituents | carbonyl grouparomatic heteromonocyclic compoundazacyclepyrrolidinylpyridineheteroaromatic compoundcarboxamide groupcarboxylic acid derivativeorganic oxidealkaloid or derivativesorganic oxygen compoundtertiary carboxylic acid amideorganonitrogen compoundorganopnictogen compoundhydrocarbon derivativeorganic nitrogen compoundpyrrolidineorganooxygen compound |
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