| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-20 23:42:46 UTC |
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| Update Date | 2025-03-21 17:59:31 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID00021498 |
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| Frequency | 271.0 |
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| Structure | |
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| Chemical Formula | C7H5N3O3 |
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| Molecular Mass | 179.0331 |
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| SMILES | O=c1ccc2c(=O)[nH]c(=O)[nH]c2[nH]1 |
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| InChI Key | VMIGDTDWSCPRSL-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 | pyrido[2,3-d]pyrimidines |
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| Direct Parent | pyrido[2,3-d]pyrimidines |
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| Geometric Descriptor | aromatic heteropolycyclic compounds |
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| Alternative Parents | 2-halopyridinesazacyclic compoundsheteroaromatic compoundshydrocarbon derivativeslactamsorganic carbonic acids and derivativesorganic oxidesorganonitrogen compoundsorganooxygen compoundsorganopnictogen compoundspolyhalopyridinespyridines and derivativespyridinonespyrimidonesvinylogous amides |
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| Substituents | vinylogous amidecarbonic acid derivativelactamazacyclepolyhalopyridineheteroaromatic compoundpyrimidonepyrimidineorganic oxidepyridinepyrido[2,3-d]pyrimidineorganic oxygen compoundaromatic heteropolycyclic compoundorganonitrogen compoundorganopnictogen compoundhydrocarbon derivative2-halopyridineorganic nitrogen compoundpyridinoneorganooxygen compound |
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