| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 03:29:16 UTC |
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| Update Date | 2025-03-21 22:20:02 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID00554556 |
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| Frequency | 3.0 |
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| Structure | |
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| Chemical Formula | C7H8N2O |
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| Molecular Mass | 136.0637 |
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| SMILES | O=C1CCCc2nc[nH]c21 |
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| InChI Key | RBTNKOKYJAHDSF-UHFFFAOYSA-N |
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| Chemical Taxonomy |
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| Kingdom | organic compounds |
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| Superclass | organic oxygen compounds |
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| Class | organooxygen compounds |
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| Subclass | carbonyl compounds |
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| Direct Parent | aryl alkyl ketones |
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| Geometric Descriptor | aromatic heteropolycyclic compounds |
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| Alternative Parents | azacyclic compoundsheteroaromatic compoundshydrocarbon derivativesimidazolesorganic oxidesorganonitrogen compoundsorganooxygen compoundsorganopnictogen compounds |
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| Substituents | aryl alkyl ketoneazacycleheteroaromatic compoundorganic oxidearomatic heteropolycyclic compoundimidazoleorganonitrogen compoundorganopnictogen compoundhydrocarbon derivativeorganic nitrogen compoundorganoheterocyclic compoundazole |
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