| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 00:25:50 UTC |
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| Update Date | 2025-03-21 18:39:08 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID00124254 |
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| Frequency | 20.7 |
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| Structure | |
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| Chemical Formula | C13H14N4O8 |
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| Molecular Mass | 354.0812 |
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| SMILES | Nc1nc2c(c(=O)[nH]1)c(=O)c(C(=O)O)cn2C1OC(CO)C(O)C1O |
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| InChI Key | SIRSPGMVUBUYTH-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-halopyridinesamino acidsazacyclic compoundscarboxylic acidsheteroaromatic compoundshydrocarbon derivativeshydroxypyridineslactamsmonocarboxylic acids and derivativesmonosaccharidesorganic oxidesorganopnictogen compoundsoxacyclic compoundspolyhalopyridinesprimary alcoholsprimary aminespyridine-3-carboxylic acidspyrimidonessecondary alcoholstetrahydrofuransvinylogous amides |
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| Substituents | pyridine carboxylic acid or derivativeslactamcarboxylic acidamino acid or derivativesamino acidpyridine-3-carboxylic acidpolyhalopyridinemonosaccharidepyrimidonecarboxylic acid derivativepyrimidinesaccharideorganic oxidearomatic heteropolycyclic compoundorganonitrogen compoundorganopnictogen compound2-halopyridineprimary alcoholalcoholvinylogous amideazacycletetrahydrofuranheteroaromatic compoundhydroxypyridineoxacyclemonocarboxylic acid or derivativespyridineorganic oxygen compoundpyrido[2,3-d]pyrimidinepyridine carboxylic acidsecondary alcoholhydrocarbon derivativeprimary amineorganic nitrogen compoundamineorganooxygen compound |
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