| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 15:17:04 UTC |
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| Update Date | 2025-03-25 00:59:57 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02240229 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C5H8N2O7 |
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| Molecular Mass | 208.0332 |
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| SMILES | NC(CC(O[N+](=O)[O-])C(=O)O)C(=O)O |
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| InChI Key | NPFNWNRHIFCUKK-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 | glutamic acid and derivatives |
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| Geometric Descriptor | aliphatic acyclic compounds |
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| Alternative Parents | alkyl nitratesalpha amino acidscarbonyl compoundscarboxylic acidsdicarboxylic acids and derivativeshydrocarbon derivativesmonoalkylaminesnitrate estersnitro fatty acidsorganic nitro compoundsorganic oxidesorganonitrogen compoundsorganopnictogen compoundsshort-chain hydroxy acids and derivatives |
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| Substituents | fatty acylaliphatic acyclic compoundcarbonyl groupcarboxylic acidshort-chain hydroxy acidallyl-type 1,3-dipolar organic compoundfatty acidorganic nitro compoundnitro fatty acidorganic oxidealkyl nitrateorganonitrogen compoundalpha-amino acidorganopnictogen compoundorganic nitric acid or derivativesorganic nitratenitrate esterorganic 1,3-dipolar compoundglutamic acid or derivativesorganic oxygen compounddicarboxylic acid or derivativeshydrocarbon derivativeprimary aliphatic amineorganic nitrogen compoundorganooxygen compoundorganic hyponitrite |
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