| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 00:29:03 UTC |
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| Update Date | 2025-03-21 18:40:59 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID00131947 |
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| Frequency | 19.2 |
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| Structure | |
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| Chemical Formula | C12H12N2O3 |
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| Molecular Mass | 232.0848 |
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| SMILES | CC(=O)C1CCC(=O)N1C(=O)c1cccnc1 |
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| InChI Key | AGVHALUYLJRRPR-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 | pyridinecarboxylic acids and derivatives |
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| Direct Parent | pyridinecarboxylic acids and derivatives |
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| Geometric Descriptor | aromatic heteromonocyclic compounds |
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| Alternative Parents | azacyclic compoundscarboxylic acids and derivativesdicarboximidesheteroaromatic compoundshydrocarbon derivativesketonesmethylpyridinesn-acylpyrrolidinesn-substituted carboxylic acid imidesorganic oxidesorganonitrogen compoundsorganopnictogen compoundspyrrolidine-2-ones |
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| Substituents | pyridine carboxylic acid or derivatives2-pyrrolidonecarbonyl grouparomatic heteromonocyclic compoundn-acylpyrrolidinecarboxylic acid derivativeketoneorganic oxideorganonitrogen compoundorganopnictogen compounddicarboximidepyrrolidinecarboxylic acid imide, n-substitutedpyrrolidoneazacycleheteroaromatic compoundmethylpyridinecarboxylic acid imideorganic oxygen compoundhydrocarbon derivativeorganic nitrogen compoundorganooxygen compound |
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