| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 00:14:08 UTC |
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| Update Date | 2025-03-21 18:33:27 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID00095916 |
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| Frequency | 28.9 |
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| Structure | |
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| Chemical Formula | C6H5N5 |
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| Molecular Mass | 147.0545 |
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| SMILES | Nc1nccnc2ncnc1-2 |
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| InChI Key | KRGGAPZVNVKYOI-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 | diazepines |
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| Subclass | 1,4-diazepines |
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| Direct Parent | 1,4-diazepines |
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| Geometric Descriptor | aromatic heteropolycyclic compounds |
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| Alternative Parents | azacyclic compoundsheteroaromatic compoundshydrocarbon derivativesimidazolesimidolactamsorganopnictogen compoundsprimary amines |
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| Substituents | azacycleheteroaromatic compoundpara-diazepinearomatic heteropolycyclic compoundimidazoleorganonitrogen compoundorganopnictogen compoundhydrocarbon derivativeprimary amineorganic nitrogen compoundimidolactamamineazole |
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