| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 14:58:10 UTC |
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| Update Date | 2025-03-25 00:52:56 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02196966 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C13H26NO2+ |
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| Molecular Mass | 228.1958 |
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| SMILES | CCC=CCCCCC(C(=O)O)[N+](C)(C)C |
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| InChI Key | AUXQXBRXZUQLNY-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 | alpha amino acids |
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| Geometric Descriptor | aliphatic acyclic compounds |
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| Alternative Parents | aminesamino fatty acidscarbonyl compoundscarboxylic acidsfatty acylshydrocarbon derivativesmedium-chain fatty acidsmonocarboxylic acids and derivativesorganic cationsorganic oxidesorganic saltsorganopnictogen compoundstetraalkylammonium salts |
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| Substituents | fatty acylaliphatic acyclic compoundcarbonyl groupcarboxylic acidtetraalkylammonium saltquaternary ammonium saltamino fatty acidorganic oxidemonocarboxylic acid or derivativesorganic oxygen compoundalpha-amino acidorganonitrogen compoundorganopnictogen compoundhydrocarbon derivativemedium-chain fatty acidorganic nitrogen compoundorganic cationorganic saltamineorganooxygen compound |
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