Record Information |
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HMDB Status | Not Available |
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Creation Date | 2024-02-20 23:47:02 UTC |
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Update Date | 2025-03-21 18:01:11 UTC |
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HMDB ID | Not Available |
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Metabolite Identification |
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DeepMet ID | DMID00031422 |
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Frequency | 117.3 |
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Structure | |
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Chemical Formula | C9H10N2O5 |
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Molecular Mass | 226.059 |
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SMILES | NC(Cn1ccc(=O)c(C(=O)O)c1)C(=O)O |
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InChI Key | OJPHKBUALBKQHI-UHFFFAOYSA-N |
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Chemical Taxonomy |
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Kingdom | organic compounds |
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Superclass | organic acids and derivatives |
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Class | carboxylic acids and derivatives |
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Subclass | amino acids, peptides, and analogues |
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Direct Parent | alpha amino acids |
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Geometric Descriptor | aromatic heteromonocyclic compounds |
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Alternative Parents | azacyclic compoundscarbonyl compoundscarboxylic acidscyclic ketonesdicarboxylic acids and derivativesheteroaromatic compoundshydrocarbon derivativeshydroxypyridinesmonoalkylaminesorganic oxidesorganonitrogen compoundsorganopnictogen compoundspyridine-3-carboxylic acidsvinylogous amides |
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Substituents | pyridine carboxylic acid or derivativescarbonyl groupcarboxylic acidaromatic heteromonocyclic compoundpyridine-3-carboxylic acidcyclic ketoneorganic oxideorganonitrogen compoundalpha-amino acidorganopnictogen compoundorganoheterocyclic compoundvinylogous amideazacycleheteroaromatic compoundhydroxypyridinepyridineorganic oxygen compoundpyridine carboxylic aciddicarboxylic acid or derivativeshydrocarbon derivativeprimary aliphatic amineorganic nitrogen compoundorganooxygen compound |
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