| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 04:48:24 UTC |
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| Update Date | 2025-03-24 14:03:38 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID00742778 |
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| Frequency | 2.1 |
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| Structure | |
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| Chemical Formula | C4H5N3O3 |
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| Molecular Mass | 143.0331 |
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| SMILES | Cn1cc([N+](=O)[O-])[nH]c1=O |
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| InChI Key | QIWNPZFMFATISN-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 | nitroimidazoles |
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| Geometric Descriptor | aromatic heteromonocyclic compounds |
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| Alternative Parents | azacyclic compoundsheteroaromatic compoundshydrocarbon derivativesimidazolesn-substituted imidazolesnitroaromatic compoundsorganic carbonic acids and derivativesorganic oxidesorganic oxoanionic compoundsorganic oxoazanium compoundsorganonitrogen compoundsorganooxygen compoundsorganopnictogen compoundspropargyl-type 1,3-dipolar organic compounds |
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| Substituents | aromatic heteromonocyclic compoundallyl-type 1,3-dipolar organic compoundorganic nitro compoundpropargyl-type 1,3-dipolar organic compoundorganic oxidenitroimidazolec-nitro compoundorganonitrogen compoundorganopnictogen compoundorganic oxoazaniumn-substituted imidazolenitroaromatic compoundcarbonic acid derivativeazacycleheteroaromatic compoundorganic 1,3-dipolar compoundorganic oxygen compoundhydrocarbon derivativeorganic nitrogen compoundorganooxygen compoundorganic hyponitrite |
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