| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 14:50:53 UTC |
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| Update Date | 2025-03-25 00:50:22 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02180532 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C13H21N2O2+ |
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| Molecular Mass | 237.1598 |
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| SMILES | C[N+](C)(C)CC1Cc2cc(O)c(O)cc2CN1 |
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| InChI Key | UDDQNQNQNTYPOI-UHFFFAOYSA-O |
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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 | 1-hydroxy-2-unsubstituted benzenoidsazacyclic compoundsbenzenoidsdialkylamineshydrocarbon derivativesorganic cationsorganic saltsorganooxygen compoundsorganopnictogen compoundstetraalkylammonium salts |
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| Substituents | secondary aliphatic aminetetraalkylammonium saltazacyclequaternary ammonium salt1-hydroxy-2-unsubstituted benzenoidsecondary amineorganic oxygen compoundaromatic heteropolycyclic compoundorganonitrogen compoundtetrahydroisoquinolineorganopnictogen compoundhydrocarbon derivativebenzenoidorganic nitrogen compoundorganic cationorganic saltamineorganooxygen compound |
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