| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 14:53:36 UTC |
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| Update Date | 2025-03-25 00:51:24 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02186729 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C7H8N4O |
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| Molecular Mass | 164.0698 |
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| SMILES | Nc1ccnc2c1C(=O)NCN2 |
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| InChI Key | RXWCCNKPYNTBFQ-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-halopyridinesamino acids and derivativesazacyclic compoundscarboxylic acids and derivativesheteroaromatic compoundshydrocarbon derivativesimidolactamslactamsorganic oxidesorganooxygen compoundsorganopnictogen compoundspolyhalopyridinesprimary aminespyridines and derivativespyrimidines and pyrimidine derivativessecondary alkylarylaminessecondary carboxylic acid amidesvinylogous amides |
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| Substituents | lactamamino acid or derivativespolyhalopyridinecarboxylic acid derivativepyrimidineorganic oxidearomatic heteropolycyclic compoundorganonitrogen compoundpyridopyrimidineorganopnictogen compound2-halopyridineimidolactamvinylogous amideazacycleheteroaromatic compoundsecondary aminecarboxamide groupsecondary aliphatic/aromatic aminesecondary carboxylic acid amidepyridineorganic oxygen compoundhydrocarbon derivativeprimary amineorganic nitrogen compoundamineorganooxygen compound |
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