| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-20 23:41:09 UTC |
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| Update Date | 2025-03-21 17:58:57 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID00017866 |
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| Frequency | 297.7 |
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| Structure | |
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| Chemical Formula | C7H10N4O |
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| Molecular Mass | 166.0855 |
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| SMILES | Nc1nc(=O)c2c([nH]1)NCCC2 |
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| InChI Key | PRQFDDYAWVNJMM-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 alkylarylaminesvinylogous amides |
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| Substituents | vinylogous amideazacycleheteroaromatic compoundpyrimidonesecondary aminesecondary aliphatic/aromatic aminepyrimidineorganic oxidepyridineorganic oxygen compoundaromatic heteropolycyclic compoundorganonitrogen compoundpyridopyrimidineorganopnictogen compoundhydrocarbon derivativeprimary amineorganic nitrogen compoundamineorganooxygen compound |
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