Record Information |
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HMDB Status | Not Available |
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Creation Date | 2024-02-21 00:31:20 UTC |
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Update Date | 2025-03-21 18:41:59 UTC |
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HMDB ID | Not Available |
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Metabolite Identification |
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DeepMet ID | DMID00137124 |
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Frequency | 18.2 |
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Structure | |
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Chemical Formula | C6H16NO2+ |
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Molecular Mass | 134.1176 |
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SMILES | CC(O)C(O)[N+](C)(C)C |
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InChI Key | LFYCFROESIVCOM-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 | hemiaminalshydrocarbon derivativesorganic cationsorganic saltsorganonitrogen compoundsorganopnictogen compoundssecondary alcoholstetraalkylammonium salts |
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Substituents | alcoholaliphatic acyclic compoundtetraalkylammonium salthemiaminalorganic oxygen compoundcholinesecondary alcoholorganopnictogen compoundhydrocarbon derivativeorganic cationorganic saltorganooxygen compoundalkanolamine |
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