| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 14:46:59 UTC |
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| Update Date | 2025-03-25 00:49:02 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02171548 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C9H13N3O |
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| Molecular Mass | 179.1059 |
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| SMILES | CN(C)Cc1ccc(C(N)=O)nc1 |
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| InChI Key | NCZZALCCYALJFE-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 | 2-halopyridines2-heteroaryl carboxamidesamino acids and derivativesaralkylaminesazacyclic compoundscarboxylic acids and derivativesheteroaromatic compoundshydrocarbon derivativesmethylpyridinesorganic oxidesorganooxygen compoundsorganopnictogen compoundspolyhalopyridinesprimary carboxylic acid amidestrialkylamines |
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| Substituents | primary carboxylic acid amidepyridine carboxylic acid or derivativesaromatic heteromonocyclic compoundamino acid or derivativespolyhalopyridinecarboxylic acid derivative2-heteroaryl carboxamidearalkylamineorganic oxideorganonitrogen compoundorganopnictogen compound2-halopyridinetertiary amineazacycleheteroaromatic compoundtertiary aliphatic aminemethylpyridinecarboxamide grouporganic oxygen compoundhydrocarbon derivativeorganic nitrogen compoundamineorganooxygen compound |
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