| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 14:56:31 UTC |
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| Update Date | 2025-03-25 00:52:22 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02193267 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C12H27N2O2+ |
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| Molecular Mass | 231.2067 |
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| SMILES | CCCCCC(O)C(O)=NCC[N+](C)(C)C |
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| InChI Key | HOSQPIHYEIHBCP-UHFFFAOYSA-O |
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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 | tetraalkylammonium salts |
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| Geometric Descriptor | aliphatic acyclic compounds |
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| Alternative Parents | aminescarboximidic acidshydrocarbon derivativesorganic cationsorganic saltsorganopnictogen compoundssecondary alcohols |
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| Substituents | alcoholaliphatic acyclic compoundcarboximidic acidtetraalkylammonium saltorganic oxygen compoundsecondary alcoholorganopnictogen compoundhydrocarbon derivativeorganic cationorganic saltamineorganooxygen compound |
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