| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 15:15:14 UTC |
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| Update Date | 2025-03-25 00:59:16 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02236129 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C13H22NO3+ |
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| Molecular Mass | 240.1594 |
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| SMILES | COc1cc(CC(OC)[N+](C)(C)C)ccc1O |
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| InChI Key | MCJLWKUWLHBRIR-UHFFFAOYSA-O |
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| Chemical Taxonomy |
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| Kingdom | organic compounds |
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| Superclass | benzenoids |
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| Class | phenols |
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| Subclass | methoxyphenols |
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| Direct Parent | methoxyphenols |
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| Geometric Descriptor | aromatic homomonocyclic compounds |
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| Alternative Parents | 1-hydroxy-2-unsubstituted benzenoidsalkyl aryl ethersanisoleshemiaminalshydrocarbon derivativesmethoxybenzenesorganic cationsorganic saltsorganonitrogen compoundsorganopnictogen compoundsphenoxy compoundstetraalkylammonium salts |
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| Substituents | phenol ethermonocyclic benzene moietyethertetraalkylammonium salt1-hydroxy-2-unsubstituted benzenoidmethoxyphenolalkyl aryl ethermethoxybenzenehemiaminalaromatic homomonocyclic compoundorganic oxygen compoundanisoleorganonitrogen compoundorganopnictogen compoundhydrocarbon derivativeorganic nitrogen compoundorganic cationphenoxy compoundorganic saltorganooxygen compound |
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