| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 14:53:55 UTC |
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| Update Date | 2025-03-25 00:51:31 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02187460 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C9H18NO2+ |
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| Molecular Mass | 172.1332 |
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| SMILES | CC(C)C1CC(C(=O)O)[N+]1(C)C |
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| InChI Key | VUWNAPXKKHBVQU-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 heteromonocyclic compounds |
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| Alternative Parents | aminesazacyclic compoundsazetidinecarboxylic acidsazetidinescarbonyl compoundscarboxylic acidshydrocarbon derivativesmonocarboxylic acids and derivativesorganic cationsorganic oxidesorganic saltsorganopnictogen compoundstetraalkylammonium salts |
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| Substituents | carbonyl groupcarboxylic acidtetraalkylammonium saltazacyclequaternary ammonium saltazetidinecarboxylic acidazetidineorganic oxidemonocarboxylic acid or derivativesorganic oxygen compoundaliphatic heteromonocyclic compoundalpha-amino acidorganonitrogen compoundorganopnictogen compoundhydrocarbon derivativeorganic cationorganic nitrogen compoundorganic saltorganoheterocyclic compoundamineorganooxygen compound |
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