| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 14:59:40 UTC |
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| Update Date | 2025-03-25 00:53:34 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02200514 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C13H20NO+ |
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| Molecular Mass | 206.1539 |
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| SMILES | COc1ccc(C[N+]2(C)CCCC2)cc1 |
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| InChI Key | UGQBKEXMXAIOLK-UHFFFAOYSA-N |
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| Chemical Taxonomy |
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| Kingdom | organic compounds |
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| Superclass | benzenoids |
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| Class | phenol ethers |
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| Subclass | anisoles |
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| Direct Parent | anisoles |
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| Geometric Descriptor | aromatic heteromonocyclic compounds |
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| Alternative Parents | alkyl aryl ethersaralkylaminesazacyclic compoundsbenzylamineshydrocarbon derivativesmethoxybenzenesn-alkylpyrrolidinesorganic cationsorganic saltsorganopnictogen compoundsphenoxy compoundsphenylmethylaminestetraalkylammonium salts |
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| Substituents | monocyclic benzene moietyetheraromatic heteromonocyclic compoundalkyl aryl etheraralkylamineorganonitrogen compoundorganopnictogen compoundorganic cationorganic saltpyrrolidineorganoheterocyclic compoundtetraalkylammonium saltazacyclen-alkylpyrrolidinequaternary ammonium saltmethoxybenzenephenylmethylamineorganic oxygen compoundbenzylamineanisolehydrocarbon derivativeorganic nitrogen compoundphenoxy compoundamineorganooxygen compound |
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