| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 07:54:27 UTC |
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| Update Date | 2025-03-24 22:24:52 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID01188850 |
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| Frequency | 1.1 |
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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 | Cc1cnc2nncn2c1 |
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| InChI Key | XGURBWVYOBTWHT-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 | triazolopyrimidines |
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| Subclass | triazolopyrimidines |
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| Direct Parent | triazolopyrimidines |
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| Geometric Descriptor | aromatic heteropolycyclic compounds |
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| Alternative Parents | azacyclic compoundsheteroaromatic compoundshydrocarbon derivativesorganonitrogen compoundsorganopnictogen compoundspyrimidines and pyrimidine derivativestriazoles |
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| Substituents | triazole1,2,4-triazoleazacycleheteroaromatic compoundpyrimidinearomatic heteropolycyclic compoundorganonitrogen compoundorganopnictogen compoundhydrocarbon derivativeorganic nitrogen compoundtriazolopyrimidineazole |
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