| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 10:59:12 UTC |
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| Update Date | 2025-03-24 20:58:45 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID01631700 |
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| Frequency | 0.8 |
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| Structure | |
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| Chemical Formula | C6H4N4 |
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| Molecular Mass | 132.0436 |
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| SMILES | N#Cc1cc2[nH]cnc2[nH]1 |
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| InChI Key | DAIHHEBVEXBOGW-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 | azoles |
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| Subclass | imidazoles |
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| Direct Parent | imidazoles |
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| Geometric Descriptor | aromatic heteropolycyclic compounds |
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| Alternative Parents | azacyclic compoundsheteroaromatic compoundshydrocarbon derivativesnitrilesorganonitrogen compoundsorganopnictogen compoundspyrroles |
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| Substituents | nitrileazacycleheteroaromatic compoundaromatic heteropolycyclic compoundimidazolepyrroleorganonitrogen compoundorganopnictogen compoundhydrocarbon derivativeorganic nitrogen compoundcarbonitrile |
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