| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 15:07:55 UTC |
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| Update Date | 2025-03-25 00:56:37 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02219664 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C15H23N2O2+ |
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| Molecular Mass | 263.1754 |
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| SMILES | COc1cc2c(CC(C)[N+](C)(C)C)c[nH]c2cc1O |
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| InChI Key | PEGAPSDWCLQZAO-UHFFFAOYSA-O |
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| Chemical Taxonomy |
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| Kingdom | organic compounds |
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| Superclass | alkaloids and derivatives |
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| Class | Not Available |
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| Subclass | alkaloids and derivatives |
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| Direct Parent | alkaloids and derivatives |
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| Geometric Descriptor | aromatic heteropolycyclic compounds |
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| Alternative Parents | 1-hydroxy-2-unsubstituted benzenoidsalkyl aryl ethersaminesanisolesazacyclic compoundsheteroaromatic compoundshydrocarbon derivativesindolesorganic cationsorganic saltsorganopnictogen compoundspyrrolestetraalkylammonium salts |
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| Substituents | phenol etheretherindole1-hydroxy-2-unsubstituted benzenoidalkyl aryl etheraromatic heteropolycyclic compoundorganonitrogen compoundorganopnictogen compoundorganic cationorganic saltorganoheterocyclic compoundtetraalkylammonium saltazacyclequaternary ammonium saltheteroaromatic compoundindole or derivativesalkaloid or derivativesorganic oxygen compoundanisolepyrrolehydrocarbon derivativebenzenoidorganic nitrogen compoundamineorganooxygen compound |
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