| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 00:08:40 UTC |
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| Update Date | 2025-03-21 18:30:41 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID00082997 |
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| Frequency | 34.7 |
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| Structure | |
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| Chemical Formula | C8H18NO2+ |
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| Molecular Mass | 160.1332 |
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| SMILES | CC(=O)CC(O)C[N+](C)(C)C |
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| InChI Key | BFYZLYZJCKIMHE-UHFFFAOYSA-N |
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| Chemical Taxonomy |
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| Kingdom | organic compounds |
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| Superclass | organic nitrogen compounds |
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| Class | organonitrogen compounds |
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| Subclass | quaternary ammonium salts |
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| Direct Parent | cholines |
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| Geometric Descriptor | aliphatic acyclic compounds |
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| Alternative Parents | 1,2-aminoalcoholsaminesbeta-hydroxy ketonesgamma-amino ketoneshydrocarbon derivativesorganic cationsorganic oxidesorganic saltsorganopnictogen compoundssecondary alcoholstetraalkylammonium salts |
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| Substituents | alcoholbeta-hydroxy ketonealiphatic acyclic compoundcarbonyl groupgamma-aminoketonetetraalkylammonium salt1,2-aminoalcoholketoneorganic oxideorganic oxygen compoundcholinesecondary alcoholorganopnictogen compoundhydrocarbon derivativeorganic cationorganic saltamineorganooxygen compound |
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