| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 14:40:02 UTC |
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| Update Date | 2025-03-25 00:46:33 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02155887 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C13H18NO+ |
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| Molecular Mass | 204.1383 |
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| SMILES | CC(=O)C1Cc2ccccc2C[N+]1(C)C |
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| InChI Key | XZQFXLVMWDWVCJ-UHFFFAOYSA-N |
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| Chemical Taxonomy |
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| Kingdom | organic compounds |
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| Superclass | organoheterocyclic compounds |
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| Class | tetrahydroisoquinolines |
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| Subclass | tetrahydroisoquinolines |
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| Direct Parent | tetrahydroisoquinolines |
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| Geometric Descriptor | aromatic heteropolycyclic compounds |
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| Alternative Parents | alpha-amino ketonesaralkylaminesazacyclic compoundsbenzenoidshydrocarbon derivativesorganic cationsorganic oxidesorganic saltsorganopnictogen compoundstetraalkylammonium salts |
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| Substituents | carbonyl grouptetraalkylammonium saltazacyclequaternary ammonium saltaralkylamineketoneorganic oxideorganic oxygen compoundalpha-aminoketonearomatic heteropolycyclic compoundorganonitrogen compoundtetrahydroisoquinolineorganopnictogen compoundhydrocarbon derivativebenzenoidorganic nitrogen compoundorganic cationorganic saltamineorganooxygen compound |
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