| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 15:10:20 UTC |
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| Update Date | 2025-03-25 00:57:30 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02225184 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C12H12N8O |
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| Molecular Mass | 284.1134 |
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| SMILES | Nc1nc(=O)c2nc(CNc3cccnc3N)cnc2[nH]1 |
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| InChI Key | ISFQXMNEQXSFQT-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 | pteridines and derivatives |
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| Subclass | pterins and derivatives |
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| Direct Parent | pterins and derivatives |
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| Geometric Descriptor | aromatic heteropolycyclic compounds |
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| Alternative Parents | 2-halopyridinesazacyclic compoundsheteroaromatic compoundshydrocarbon derivativesimidolactamsorganic oxidesorganooxygen compoundsorganopnictogen compoundspolyhalopyridinesprimary aminespyrazinespyridines and derivativespyrimidonessecondary alkylarylaminesvinylogous amides |
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| Substituents | polyhalopyridinepyrimidonepyrimidineorganic oxidearomatic heteropolycyclic compoundorganonitrogen compoundorganopnictogen compound2-halopyridineimidolactamvinylogous amidepterinazacycleheteroaromatic compoundsecondary aminesecondary aliphatic/aromatic aminepyridineorganic oxygen compoundpyrazinehydrocarbon derivativeprimary amineorganic nitrogen compoundamineorganooxygen compound |
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