| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 15:16:30 UTC |
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| Update Date | 2025-03-25 00:59:44 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02238962 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C8H8N2O5 |
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| Molecular Mass | 212.0433 |
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| SMILES | NC(=O)c1nc(CO)cc(C(=O)O)c1O |
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| InChI Key | BCFREQNHEYDCIE-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 |
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| Geometric Descriptor | aromatic heteromonocyclic compounds |
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| Alternative Parents | 1-carboxy-2-haloaromatic compounds2-halopyridines2-heteroaryl carboxamidesaromatic alcoholsazacyclic compoundsheteroaromatic compoundshydrocarbon derivativeshydroxypyridinesmonocarboxylic acids and derivativesorganic oxidesorganonitrogen compoundsorganopnictogen compoundspolyhalopyridinesprimary carboxylic acid amidesvinylogous acids |
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| Substituents | aromatic alcoholprimary carboxylic acid amidecarboxylic acidaromatic heteromonocyclic compoundpolyhalopyridinecarboxylic acid derivative2-heteroaryl carboxamideorganic oxideorganonitrogen compoundorganopnictogen compound1-carboxy-2-haloaromatic compound2-halopyridinealcoholazacycleheteroaromatic compoundhydroxypyridinecarboxamide groupvinylogous acidmonocarboxylic acid or derivativesorganic oxygen compoundpyridine carboxylic acidhydrocarbon derivativeorganic nitrogen compoundorganooxygen compound |
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