| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 15:05:35 UTC |
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| Update Date | 2025-03-25 00:55:48 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02214284 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C5H8N2O6 |
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| Molecular Mass | 192.0382 |
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| SMILES | CN(C(CC(=O)O)C(=O)O)[N+](=O)[O-] |
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| InChI Key | WNAKOKQIBLCCKJ-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 | aspartic acid and derivatives |
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| Geometric Descriptor | aliphatic acyclic compounds |
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| Alternative Parents | alpha amino acidscarbonyl compoundscarboxylic acidsdicarboxylic acids and derivativeshydrocarbon derivativesnitraminesnitro fatty acidsorganic oxidesorganic oxoanionic compoundsorganonitrogen compoundsorganopnictogen compounds |
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| Substituents | fatty acylaliphatic acyclic compoundcarbonyl groupcarboxylic acidallyl-type 1,3-dipolar organic compoundfatty acidorganic 1,3-dipolar compoundorganic nitro compoundnitro fatty acidorganic oxidenitramineorganic oxygen compoundaspartic acid or derivativesorganonitrogen compoundalpha-amino aciddicarboxylic acid or derivativesorganopnictogen compoundhydrocarbon derivativeorganic nitrogen compoundorganooxygen compoundorganic hyponitrite |
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