| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 14:53:11 UTC |
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| Update Date | 2025-03-25 00:51:15 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02185724 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C15H22N8O2 |
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| Molecular Mass | 346.1866 |
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| SMILES | Nc1nc(=O)c2c([nH]1)NCC(N1CCN(C(=O)C3CCCN3)CC1)=N2 |
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| InChI Key | NMDZSLQRMDXZMU-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 | alpha amino acid amidesalpha amino acidsamidinesazacyclic compoundscarbonyl compoundscarboxylic acids and derivativesdialkylaminesheteroaromatic compoundshydrocarbon derivativesimidolactamsorganic oxidesorganopnictogen compoundspiperazinesprimary aminespropargyl-type 1,3-dipolar organic compoundspyrimidonespyrrolidinecarboxamidessecondary alkylarylaminestertiary carboxylic acid amidesvinylogous amides |
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| Substituents | carbonyl groupamino acid or derivativespyrimidoneamidinealpha-amino acid or derivativescarboxylic acid derivativepyrimidinepropargyl-type 1,3-dipolar organic compoundorganic oxidepiperazinearomatic heteropolycyclic compoundtertiary carboxylic acid amideorganonitrogen compoundalpha-amino acidorganopnictogen compoundpyrrolidineimidolactamvinylogous amidesecondary aliphatic aminepterinalpha-amino acid amideazacycleheteroaromatic compoundorganic 1,3-dipolar compoundsecondary aminecarboxamide groupsecondary aliphatic/aromatic aminepyrrolidine carboxylic acid or derivativesorganic oxygen compound1,4-diazinanehydrocarbon derivativeprimary amineorganic nitrogen compoundpyrrolidine-2-carboxamideamineorganooxygen compound |
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