| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 00:17:47 UTC |
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| Update Date | 2025-03-21 18:35:18 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID00104914 |
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| Frequency | 25.8 |
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| Structure | |
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| Chemical Formula | C8H9N3O2 |
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| Molecular Mass | 179.0695 |
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| SMILES | CC(=O)Nc1ccnc(C(N)=O)c1 |
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| InChI Key | DYHVHQVIGYDEAO-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 carboxamidesacetamidesazacyclic compoundscarbonyl compoundscarboxylic acids and derivativesheteroaromatic compoundshydrocarbon derivativesmethylpyridinesn-acetylarylaminesorganic oxidesorganopnictogen compoundspolyhalopyridinesprimary carboxylic acid amidessecondary carboxylic acid amides |
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| Substituents | primary carboxylic acid amidepyridine carboxylic acid or derivativescarbonyl groupn-acetylarylaminearomatic heteromonocyclic compoundpolyhalopyridinen-arylamidecarboxylic acid derivative2-heteroaryl carboxamideorganic oxideorganonitrogen compoundorganopnictogen compound2-halopyridineacetamideazacycleheteroaromatic compoundmethylpyridinecarboxamide groupsecondary carboxylic acid amideorganic oxygen compoundhydrocarbon derivativeorganic nitrogen compoundorganooxygen compound |
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