| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 06:12:51 UTC |
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| Update Date | 2025-03-24 16:43:27 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID00945086 |
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| Frequency | 1.5 |
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| Structure | |
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| Chemical Formula | C6H6N4 |
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| Molecular Mass | 134.0592 |
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| SMILES | CN1C=Nc2cc1ncn2 |
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| InChI Key | QNDNUMBCCQGOLQ-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 | diazines |
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| Subclass | pyrimidines and pyrimidine derivatives |
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| Direct Parent | pyrimidines and pyrimidine derivatives |
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| Geometric Descriptor | aromatic heteropolycyclic compounds |
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| Alternative Parents | azacyclic compoundsformamidinesheteroaromatic compoundshydrocarbon derivativesimidolactamsorganopnictogen compoundspropargyl-type 1,3-dipolar organic compounds |
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| Substituents | azacycleheteroaromatic compoundorganic 1,3-dipolar compoundamidinepyrimidinepropargyl-type 1,3-dipolar organic compoundformamidinearomatic heteropolycyclic compoundorganonitrogen compoundorganopnictogen compoundhydrocarbon derivativeorganic nitrogen compoundimidolactam |
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