| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 00:31:04 UTC |
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| Update Date | 2025-03-21 18:41:52 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID00136512 |
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| Frequency | 18.4 |
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| Structure | |
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| Chemical Formula | C10H9N3O5 |
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| Molecular Mass | 251.0542 |
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| SMILES | Cn1c(=O)c2[nH]c(C(=O)O)cc(=O)c2n(C)c1=O |
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| InChI Key | JBCQDEOJAVREAJ-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 | pyridopyrimidines |
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| Subclass | pyridopyrimidines |
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| Direct Parent | pyridopyrimidines |
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| Geometric Descriptor | aromatic heteropolycyclic compounds |
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| Alternative Parents | 2-halopyridinesazacyclic compoundscarboxylic acidsheteroaromatic compoundshydrocarbon derivativeshydroxypyridineslactamsmethylpyridinesmonocarboxylic acids and derivativesorganic oxidesorganonitrogen compoundsorganooxygen compoundsorganopnictogen compoundspolyhalopyridinespyridine-2-carboxylic acidspyrimidonesureasvinylogous amides |
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| Substituents | pyridine carboxylic acid or derivativeslactamcarboxylic acidpolyhalopyridinepyrimidonecarboxylic acid derivativepyrimidineureaorganic oxidepyridine-2-carboxylic acidaromatic heteropolycyclic compoundorganonitrogen compoundpyridopyrimidineorganopnictogen compound2-halopyridinevinylogous amidecarbonic acid derivativeazacycleheteroaromatic compoundhydroxypyridinemethylpyridinemonocarboxylic acid or derivativespyridineorganic oxygen compoundpyridine carboxylic acidhydrocarbon derivativeorganic nitrogen compoundorganooxygen compound |
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