| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 14:56:43 UTC |
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| Update Date | 2025-03-25 00:52:26 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02193717 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C12H15N3O3 |
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| Molecular Mass | 249.1113 |
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| SMILES | CN(C)CCc1c[nH]c2c(=O)cc(C(=O)O)[nH]c12 |
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| InChI Key | IVODDRZZCMTLFG-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 | pyridine-2-carboxylic acids |
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| Geometric Descriptor | aromatic heteropolycyclic compounds |
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| Alternative Parents | 2-halopyridinesamino acidsazacyclic compoundscarboxylic acidsheteroaromatic compoundshydrocarbon derivativeshydroxypyridinesmethylpyridinesmonocarboxylic acids and derivativesorganic oxidesorganooxygen compoundsorganopnictogen compoundspolyhalopyridinespyrrolestrialkylaminesvinylogous amides |
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| Substituents | carboxylic acidamino acid or derivativesamino acidpolyhalopyridinecarboxylic acid derivativeorganic oxidepyridine-2-carboxylic acidaromatic heteropolycyclic compoundorganonitrogen compoundorganopnictogen compound2-halopyridinetertiary aminevinylogous amideazacycleheteroaromatic compoundtertiary aliphatic aminehydroxypyridinemethylpyridinemonocarboxylic acid or derivativesorganic oxygen compoundpyrrolehydrocarbon derivativeorganic nitrogen compoundamineorganooxygen compound |
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