Record Information |
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HMDB Status | Not Available |
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Creation Date | 2024-02-21 14:53:45 UTC |
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Update Date | 2025-03-25 00:51:27 UTC |
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HMDB ID | Not Available |
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Metabolite Identification |
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DeepMet ID | DMID02187070 |
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Frequency | 0.5 |
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Structure | |
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Chemical Formula | C9H9NO3 |
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Molecular Mass | 179.0582 |
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SMILES | CC(C(=O)C(=O)O)c1cccnc1 |
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InChI Key | URRLWTUIQBSZPM-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 | alpha-hydroxy ketonesalpha-keto acids and derivativesazacyclic compoundscarboxylic acidsheteroaromatic compoundshydrocarbon derivativesmethylpyridinesmonocarboxylic acids and derivativesorganic oxidesorganonitrogen compoundsorganopnictogen compounds |
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Substituents | carbonyl groupcarboxylic acidaromatic heteromonocyclic compoundazacycleheteroaromatic compoundhydroxypyridinemethylpyridinealpha-hydroxy ketonecarboxylic acid derivativeketoneorganic oxidemonocarboxylic acid or derivativesorganic oxygen compoundketo acidorganonitrogen compoundalpha-keto acidorganopnictogen compoundhydrocarbon derivativeorganic nitrogen compoundorganooxygen compound |
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