| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 00:18:57 UTC |
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| Update Date | 2025-03-21 18:35:53 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID00107795 |
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| Frequency | 24.9 |
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| Structure | |
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| Chemical Formula | C11H18NO2+ |
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| Molecular Mass | 196.1332 |
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| SMILES | C[N+](C)(C)C(O)C(O)c1ccccc1 |
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| InChI Key | LUKKTLXQMNRMMF-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 | aromatic homomonocyclic compounds |
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| Alternative Parents | aromatic alcoholsbenzene and substituted derivativeshemiaminalshydrocarbon derivativesorganic cationsorganic saltsorganonitrogen compoundsorganopnictogen compoundssecondary alcoholstetraalkylammonium salts |
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| Substituents | aromatic alcoholalcoholmonocyclic benzene moietytetraalkylammonium salthemiaminalaromatic homomonocyclic compoundorganic oxygen compoundcholinesecondary alcoholorganopnictogen compoundhydrocarbon derivativebenzenoidorganic cationorganic saltorganooxygen compoundalkanolamine |
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