| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 15:01:11 UTC |
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| Update Date | 2025-03-25 00:54:05 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02203968 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C12H13N3O5 |
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| Molecular Mass | 279.0855 |
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| SMILES | O=c1nc2n(C3CC(O)C(CO)O3)cccc-2c(=O)[nH]1 |
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| InChI Key | SHZFEHAJPMMETM-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 derivativeshydroxypyridineslactamsmonosaccharidesorganic carbonic acids and derivativesorganic oxidesorganonitrogen compoundsorganopnictogen compoundsoxacyclic compoundspolyhalopyridinesprimary alcoholspyrimidonessecondary alcoholstetrahydrofurans |
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| Substituents | lactampolyhalopyridinemonosaccharidepyrimidonepyrimidinesaccharideorganic oxidearomatic heteropolycyclic compoundorganonitrogen compoundorganopnictogen compound2-halopyridineprimary alcoholalcoholcarbonic acid derivativeazacycletetrahydrofuranheteroaromatic compoundhydroxypyridineoxacyclepyridineorganic oxygen compoundpyrido[2,3-d]pyrimidinesecondary alcoholhydrocarbon derivativeorganic nitrogen compoundorganooxygen compound |
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