| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 02:24:53 UTC |
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| Update Date | 2025-03-21 20:55:11 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID00402057 |
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| Frequency | 4.5 |
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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 | O=C1CNC(=C[N+](=O)[O-])N1 |
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| InChI Key | WZBDXCJBQWKCTH-UHFFFAOYSA-N |
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| Chemical Taxonomy |
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| Kingdom | organic compounds |
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| Superclass | organic acids and derivatives |
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| Class | carboxylic acids and derivatives |
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| Subclass | amino acids, peptides, and analogues |
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| Direct Parent | alpha amino acids |
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| Geometric Descriptor | aliphatic heteromonocyclic compounds |
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| Alternative Parents | azacyclic compoundsc-nitro compoundscarbonyl compoundscarboxylic acids and derivativesdialkylamineshydrocarbon derivativesimidazolidinoneslactamsorganic oxidesorganic oxoanionic compoundsorganic oxoazanium compoundsorganopnictogen compoundspropargyl-type 1,3-dipolar organic compoundssecondary carboxylic acid amides |
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| Substituents | imidazolidinecarbonyl grouplactamallyl-type 1,3-dipolar organic compoundorganic nitro compoundpropargyl-type 1,3-dipolar organic compoundimidazolidinoneorganic oxidec-nitro compoundaliphatic heteromonocyclic compoundorganonitrogen compoundalpha-amino acidorganopnictogen compoundorganic oxoazaniumorganoheterocyclic compoundsecondary aliphatic amineazacycleorganic 1,3-dipolar compoundsecondary aminecarboxamide groupsecondary carboxylic acid amideorganic oxygen compoundhydrocarbon derivativeorganic nitrogen compoundorganooxygen compoundamineorganic hyponitrite |
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