| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 14:56:44 UTC |
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| Update Date | 2025-03-25 00:52:26 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02193755 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C21H27ClN2 |
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| Molecular Mass | 342.1863 |
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| SMILES | CN(C)CCCC1(c2ccccc2)c2ccc(Cl)cc2CCN1C |
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| InChI Key | HXFWBNNAKMIOHS-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 | tetrahydroisoquinolines |
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| Subclass | 1-phenyltetrahydroisoquinolines |
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| Direct Parent | 1-phenyltetrahydroisoquinolines |
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| Geometric Descriptor | aromatic heteropolycyclic compounds |
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| Alternative Parents | aralkylaminesaryl chloridesazacyclic compoundshydrocarbon derivativesorganochloridesorganopnictogen compoundsphenylbutylaminestrialkylamines |
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| Substituents | aryl chloridemonocyclic benzene moietyazacycleorganochloridetertiary aliphatic amineorganohalogen compoundaralkylamine1-phenyltetrahydroisoquinolinearyl halidephenylbutylaminearomatic heteropolycyclic compoundorganonitrogen compoundorganopnictogen compoundhydrocarbon derivativebenzenoidorganic nitrogen compoundaminetertiary amine |
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