| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 15:14:53 UTC |
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| Update Date | 2025-03-25 00:59:09 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02235375 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C14H16N4O |
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| Molecular Mass | 256.1324 |
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| SMILES | Cc1ccc(C2CNc3c([nH]c(N)nc3=O)C2)cc1 |
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| InChI Key | MXYKDNAETUOIIT-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 | azacyclic compoundsheteroaromatic compoundshydrocarbon derivativesorganic oxidesorganooxygen compoundsorganopnictogen compoundsprimary aminespyridines and derivativespyrimidonessecondary alkylarylaminestoluenesvinylogous amides |
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| Substituents | vinylogous amidemonocyclic benzene moietyazacycleheteroaromatic compoundpyrimidonesecondary aminesecondary aliphatic/aromatic aminepyrimidineorganic oxidepyridineorganic oxygen compoundaromatic heteropolycyclic compoundorganonitrogen compoundpyridopyrimidineorganopnictogen compoundhydrocarbon derivativebenzenoidprimary amineorganic nitrogen compoundtolueneamineorganooxygen compound |
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