| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 16:56:57 UTC |
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| Update Date | 2025-03-25 01:38:42 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02471833 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C7H4N2O |
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| Molecular Mass | 132.0324 |
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| SMILES | N#Cc1ccc(C=O)nc1 |
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| InChI Key | DMDMMMFMXWZSLM-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-halopyridines3-pyridinecarbonitrilesaryl-aldehydesazacyclic compoundsheteroaromatic compoundshydrocarbon derivativesnitrilesorganic oxidesorganonitrogen compoundsorganooxygen compoundsorganopnictogen compoundspolyhalopyridinespyridine carboxaldehydes |
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| Substituents | pyridine carboxylic acid or derivativesnitrilearomatic heteromonocyclic compoundazacyclepolyhalopyridineheteroaromatic compoundaldehydeorganic oxide3-pyridinecarbonitrile2-pyridine carboxaldehydearyl-aldehydeorganic oxygen compoundorganonitrogen compoundorganopnictogen compoundhydrocarbon derivative2-halopyridineorganic nitrogen compoundcarbonitrileorganooxygen compound |
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