| Record Information |
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| HMDB Status | detected |
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| Creation Date | 2024-02-21 05:47:36 UTC |
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| Update Date | 2025-03-24 14:34:58 UTC |
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| HMDB ID | HMDB0245259 |
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| Metabolite Identification |
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| DeepMet ID | DMID00884608 |
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| Name | 2-Nitroimidazole |
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| Frequency | 1.6 |
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| Structure | |
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| Chemical Formula | C3H3N3O2 |
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| Molecular Mass | 113.0225 |
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| SMILES | O=[N+]([O-])c1ncc[nH]1 |
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| InChI Key | YZEUHQHUFTYLPH-UHFFFAOYSA-N |
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| Chemical Taxonomy |
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| Kingdom | organic compounds |
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| Superclass | organic 1,3-dipolar compounds |
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| Class | allyl-type 1,3-dipolar organic compounds |
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| Subclass | organic nitro compounds |
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| Direct Parent | nitroaromatic compounds |
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| Geometric Descriptor | aromatic heteromonocyclic compounds |
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| Alternative Parents | azacyclic compoundsheteroaromatic compoundshydrocarbon derivativesimidazolesorganic oxidesorganic oxoanionic compoundsorganic oxoazanium compoundsorganonitrogen compoundsorganopnictogen compoundspropargyl-type 1,3-dipolar organic compounds |
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| Substituents | nitroaromatic compoundaromatic heteromonocyclic compoundazacycleheteroaromatic compoundpropargyl-type 1,3-dipolar organic compoundorganic oxideorganic oxygen compoundimidazoleorganonitrogen compoundorganopnictogen compoundhydrocarbon derivativeorganic nitrogen compoundorganic oxoazaniumorganoheterocyclic compoundorganic hyponitriteazole |
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