| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-20 23:49:06 UTC |
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| Update Date | 2025-03-21 18:02:06 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID00036371 |
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| Frequency | 97.3 |
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| Structure | |
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| Chemical Formula | C8H14NO4+ |
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| Molecular Mass | 188.0917 |
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| SMILES | C[N+](C)(C)CC(=O)CC(=O)C(=O)O |
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| InChI Key | VJRDYZXLYMMSHC-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 | keto acids and derivatives |
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| Subclass | gamma-keto acids and derivatives |
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| Direct Parent | 3-acylpyruvic acids |
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| Geometric Descriptor | aliphatic acyclic compounds |
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| Alternative Parents | alpha-amino ketonesalpha-hydroxy ketonesalpha-keto acids and derivativesaminescarboxylic acidsgamma-amino ketoneshydrocarbon derivativesmonocarboxylic acids and derivativesorganic cationsorganic oxidesorganic saltsorganopnictogen compoundsshort-chain keto acids and derivativestetraalkylammonium salts |
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| Substituents | aliphatic acyclic compoundcarbonyl groupcarboxylic acidshort-chain keto acidalpha-hydroxy ketonecarboxylic acid derivativeketoneorganic oxidealpha-aminoketoneorganonitrogen compoundalpha-keto acidorganopnictogen compoundorganic cationorganic saltgamma-aminoketone3-acylpyruvic acidtetraalkylammonium saltquaternary ammonium saltmonocarboxylic acid or derivativesorganic oxygen compoundhydrocarbon derivativeorganic nitrogen compoundamineorganooxygen compound |
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