| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 15:14:34 UTC |
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| Update Date | 2025-03-25 00:59:02 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02234618 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C15H14ClNO |
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| Molecular Mass | 259.0764 |
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| SMILES | Oc1ccc2c(c1)CCNC2c1cccc(Cl)c1 |
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| InChI Key | XOWOATWMNLJKRJ-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 | 1-hydroxy-2-unsubstituted benzenoidsaryl chloridesazacyclic compoundschlorobenzenesdialkylamineshydrocarbon derivativesorganochloridesorganooxygen compoundsorganopnictogen compounds |
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| Substituents | aryl chloridechlorobenzenesecondary aliphatic aminemonocyclic benzene moietyazacycleorganochloride1-hydroxy-2-unsubstituted benzenoidsecondary amineorganohalogen compound1-phenyltetrahydroisoquinolinearyl halideorganic oxygen compoundaromatic heteropolycyclic compoundorganonitrogen compoundorganopnictogen compoundhydrocarbon derivativebenzenoidorganic nitrogen compoundhalobenzeneorganooxygen compoundamine |
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