Record Information |
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HMDB Status | Not Available |
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Creation Date | 2024-02-21 14:49:41 UTC |
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Update Date | 2025-03-25 00:49:58 UTC |
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HMDB ID | Not Available |
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Metabolite Identification |
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DeepMet ID | DMID02177815 |
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Frequency | 0.5 |
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Structure | |
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Chemical Formula | C9H6N2O2 |
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Molecular Mass | 174.0429 |
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SMILES | N#CC(=Cc1ccccn1)C(=O)O |
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InChI Key | AHAVZSCDURRMBH-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 | hydroxypyridines |
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Direct Parent | hydroxypyridines |
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Geometric Descriptor | aromatic heteromonocyclic compounds |
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Alternative Parents | 2-halopyridinesazacyclic compoundscarbonyl compoundscarboxylic acidsheteroaromatic compoundshydrocarbon derivativesmonocarboxylic acids and derivativesnitrilesorganic oxidesorganonitrogen compoundsorganopnictogen compounds |
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Substituents | carbonyl groupnitrilecarboxylic acidaromatic heteromonocyclic compoundazacycleheteroaromatic compoundhydroxypyridinecarboxylic acid derivativeorganic oxidemonocarboxylic acid or derivativesorganic oxygen compoundorganonitrogen compoundorganopnictogen compoundhydrocarbon derivative2-halopyridineorganic nitrogen compoundcarbonitrileorganooxygen compound |
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