| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 15:03:17 UTC |
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| Update Date | 2025-03-25 00:54:48 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02208775 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C9H7N3O4 |
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| Molecular Mass | 221.0437 |
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| SMILES | CC(=O)c1cc2c(=O)[nH]c(=O)[nH]c2[nH]c1=O |
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| InChI Key | LYTDWGHGLXEXNW-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-halopyridinesaryl alkyl ketonesazacyclic compoundsheteroaromatic compoundshydrocarbon derivativeslactamsmethylpyridinesorganic carbonic acids and derivativesorganic oxidesorganonitrogen compoundsorganooxygen compoundsorganopnictogen compoundspolyhalopyridinespyridinonespyrimidonesvinylogous amides |
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| Substituents | lactamaryl alkyl ketonepolyhalopyridinepyrimidonepyrimidineketoneorganic oxidearomatic heteropolycyclic compoundorganonitrogen compoundorganopnictogen compound2-halopyridinevinylogous amidecarbonic acid derivativeazacycleheteroaromatic compoundmethylpyridinepyridineorganic oxygen compoundpyrido[2,3-d]pyrimidinehydrocarbon derivativeorganic nitrogen compoundpyridinoneorganooxygen compoundaryl ketone |
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