| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 17:03:32 UTC |
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| Update Date | 2025-03-25 01:41:36 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02487500 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C4H8NO4+ |
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| Molecular Mass | 134.0448 |
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| SMILES | CO[N+](=O)C(C)C(=O)O |
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| InChI Key | FMIFIZZJTWQWLP-UHFFFAOYSA-O |
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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 | alanine and derivatives |
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| Geometric Descriptor | aliphatic acyclic compounds |
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| Alternative Parents | alkyl nitritesalpha amino acidscarbonyl compoundscarboxylic acidshydrocarbon derivativesmonocarboxylic acids and derivativesn-organohydroxylaminesorganic cationsorganic nitro compoundsorganic oxidesorganic oxoazanium compoundsorganopnictogen compounds |
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| Substituents | aliphatic acyclic compoundcarbonyl groupcarboxylic acidn-organohydroxylamineorganic nitro compoundalkyl nitriteorganic oxidemonocarboxylic acid or derivativesorganic oxygen compoundorganonitrogen compoundalpha-amino acidorganopnictogen compoundalanine or derivativeshydrocarbon derivativeorganic nitrogen compoundorganic cationorganic oxoazaniumorganooxygen compound |
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