| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 00:20:27 UTC |
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| Update Date | 2025-03-21 18:36:36 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID00111442 |
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| Frequency | 23.9 |
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| Structure | |
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| Chemical Formula | C10H12N4O4 |
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| Molecular Mass | 252.0859 |
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| SMILES | Nc1nc2cc(C(O)C(O)CO)cnc2c(=O)[nH]1 |
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| InChI Key | QQBBYGMUQYXUJV-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-halopyridinesaromatic alcoholsazacyclic compoundsheteroaromatic compoundshydrocarbon derivativeshydroxypyridineslactamsorganic oxidesorganopnictogen compoundspolyhalopyridinesprimary alcoholsprimary aminespyrimidonessecondary alcohols |
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| Substituents | aromatic alcohollactampolyhalopyridinepyrimidonepyrimidineorganic oxidearomatic heteropolycyclic compoundorganonitrogen compoundpyridopyrimidineorganopnictogen compound2-halopyridineprimary alcoholalcoholazacycleheteroaromatic compoundhydroxypyridinepyridineorganic oxygen compoundsecondary alcoholhydrocarbon derivativeprimary amineorganic nitrogen compoundamineorganooxygen compound |
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