| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 00:14:17 UTC |
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| Update Date | 2025-03-21 18:33:32 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID00096306 |
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| Frequency | 28.7 |
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| Structure | |
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| Chemical Formula | C6H8N2O |
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| Molecular Mass | 124.0637 |
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| SMILES | CCC(=O)n1ccnc1 |
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| InChI Key | GDBUORNHWAZSNU-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 | carbonylimidazoles |
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| Geometric Descriptor | aromatic heteromonocyclic compounds |
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| Alternative Parents | azacyclic compoundscarbonyl compoundsheteroaromatic compoundshydrocarbon derivativesimidazolesn-acylimidazolesorganic oxidesorganonitrogen compoundsorganopnictogen compounds |
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| Substituents | imidazole-1-carbonyl groupcarbonyl grouparomatic heteromonocyclic compoundazacycleheteroaromatic compoundorganic oxideorganic oxygen compoundorganonitrogen compoundorganopnictogen compoundn-acylimidazolehydrocarbon derivativeorganic nitrogen compoundorganooxygen compoundn-substituted imidazole |
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