| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 08:33:01 UTC |
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| Update Date | 2025-03-25 00:19:57 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID01283164 |
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| Frequency | 1.0 |
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| Structure | |
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| Chemical Formula | C6H5FN2O |
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| Molecular Mass | 140.0386 |
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| SMILES | NC(=O)c1ccc(F)cn1 |
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| InChI Key | CWKOQDDWKWTOCF-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 carboxamidesaryl fluoridesazacyclic compoundscarboxylic acids and derivativesheteroaromatic compoundshydrocarbon derivativesorganic oxidesorganofluoridesorganonitrogen compoundsorganooxygen compoundsorganopnictogen compoundspolyhalopyridinesprimary carboxylic acid amides |
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| Substituents | aryl fluorideprimary carboxylic acid amidepyridine carboxylic acid or derivativesaromatic heteromonocyclic compoundazacyclepolyhalopyridineorganofluorideheteroaromatic compoundcarboxamide groupcarboxylic acid derivativeorganohalogen compound2-heteroaryl carboxamidearyl halideorganic oxideorganic oxygen compoundorganonitrogen compoundorganopnictogen compoundhydrocarbon derivative2-halopyridineorganic nitrogen compoundorganooxygen compound |
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