| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 01:46:02 UTC |
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| Update Date | 2025-03-21 20:02:43 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID00310342 |
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| Frequency | 6.3 |
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| Structure | |
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| Chemical Formula | C4H7N3O3 |
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| Molecular Mass | 145.0487 |
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| SMILES | CNC(=C[N+](=O)[O-])NC=O |
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| InChI Key | XRCMPXCWFVSJAX-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 | carboxylic acid derivatives |
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| Direct Parent | secondary carboxylic acid amides |
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| Geometric Descriptor | aliphatic acyclic compounds |
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| Alternative Parents | amino acids and derivativesc-nitro compoundscarbonyl compoundscarboxylic acids and derivativesdialkylamineshydrocarbon derivativesorganic oxidesorganic oxoanionic compoundsorganic oxoazanium compoundsorganopnictogen compoundspropargyl-type 1,3-dipolar organic compounds |
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| Substituents | aliphatic acyclic compoundsecondary aliphatic aminecarbonyl groupamino acid or derivativesallyl-type 1,3-dipolar organic compoundorganic 1,3-dipolar compoundsecondary amineorganic nitro compoundpropargyl-type 1,3-dipolar organic compoundsecondary carboxylic acid amideorganic oxideorganic oxygen compoundc-nitro compoundorganonitrogen compoundorganopnictogen compoundhydrocarbon derivativeorganic nitrogen compoundorganic oxoazaniumorganooxygen compoundamineorganic hyponitrite |
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