| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 15:21:05 UTC |
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| Update Date | 2025-03-25 01:01:28 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02249599 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C18H22NO+ |
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| Molecular Mass | 268.1696 |
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| SMILES | C[N+]1(C)CCc2ccccc2C1C(O)c1ccccc1 |
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| InChI Key | HFJZBCKJAUTLGK-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 | isoquinolines and derivatives |
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| Subclass | benzylisoquinolines |
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| Direct Parent | benzylisoquinolines |
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| Geometric Descriptor | aromatic heteropolycyclic compounds |
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| Alternative Parents | 1,2-aminoalcoholsaralkylaminesaromatic alcoholsazacyclic compoundsbenzene and substituted derivativeshydrocarbon derivativesorganic cationsorganic saltsorganopnictogen compoundssecondary alcoholstetraalkylammonium saltstetrahydroisoquinolines |
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| Substituents | aromatic alcoholalcoholmonocyclic benzene moietytetraalkylammonium saltazacycle1,2-aminoalcoholquaternary ammonium saltbenzylisoquinolinearalkylamineorganic oxygen compoundaromatic heteropolycyclic compoundorganonitrogen compoundtetrahydroisoquinolinesecondary alcoholorganopnictogen compoundhydrocarbon derivativebenzenoidorganic nitrogen compoundorganic cationorganic saltamineorganooxygen compound |
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