Record Information |
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HMDB Status | Not Available |
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Creation Date | 2024-02-21 14:55:22 UTC |
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Update Date | 2025-03-25 00:51:59 UTC |
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HMDB ID | Not Available |
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Metabolite Identification |
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DeepMet ID | DMID02190703 |
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Frequency | 0.5 |
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Structure | |
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Chemical Formula | C8H14NO2+ |
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Molecular Mass | 156.1019 |
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SMILES | C#CC(=O)OCC[N+](C)(C)C |
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InChI Key | LFCRVBCOZPGEKZ-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 | acyl cholines |
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Geometric Descriptor | aliphatic acyclic compounds |
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Alternative Parents | acetylidesaminescarbonyl compoundshydrocarbon derivativesmonocarboxylic acids and derivativesorganic cationsorganic oxidesorganic saltsorganopnictogen compoundstetraalkylammonium saltsynoate esters |
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Substituents | aliphatic acyclic compoundcarbonyl groupacetylidetetraalkylammonium saltynoate estercarboxylic acid derivativealpha,beta-unsaturated carboxylic esterorganic oxidemonocarboxylic acid or derivativesorganic oxygen compoundcarboxylic acid esteracyl cholineorganopnictogen compoundhydrocarbon derivativeorganic cationorganic saltamineorganooxygen compound |
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