| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 14:53:56 UTC |
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| Update Date | 2025-03-25 00:51:31 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02187515 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C11H14N4O |
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| Molecular Mass | 218.1168 |
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| SMILES | CC(C)C(O)c1ccc2ncnc(N)c2n1 |
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| InChI Key | KPOKNNOLEHPFSZ-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 derivativeshydroxypyridinesimidolactamsmethylpyridinesorganopnictogen compoundspolyhalopyridinesprimary aminespyrimidines and pyrimidine derivativessecondary alcohols |
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| Substituents | aromatic alcoholalcoholazacyclepolyhalopyridineheteroaromatic compoundhydroxypyridinemethylpyridinepyrimidinepyridineorganic oxygen compoundaromatic heteropolycyclic compoundorganonitrogen compoundsecondary alcoholpyridopyrimidineorganopnictogen compoundhydrocarbon derivativeprimary amine2-halopyridineorganic nitrogen compoundimidolactamamineorganooxygen compound |
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