| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 15:05:45 UTC |
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| Update Date | 2025-03-25 00:55:53 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02214651 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C11H14ClNO2 |
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| Molecular Mass | 227.0713 |
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| SMILES | CC1c2cc(O)c(Cl)c(O)c2CCN1C |
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| InChI Key | IOBLUWVPJBBHES-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 | 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 benzenoids1-hydroxy-4-unsubstituted benzenoidsaralkylaminesaryl chloridesazacyclic compoundsbenzenoidshydrocarbon derivativesorganochloridesorganooxygen compoundsorganopnictogen compoundstrialkylamines |
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| Substituents | aryl chlorideazacycleorganochloridetertiary aliphatic amine1-hydroxy-2-unsubstituted benzenoid1-hydroxy-4-unsubstituted benzenoidorganohalogen compoundaralkylaminearyl halideorganic oxygen compoundaromatic heteropolycyclic compoundorganonitrogen compoundtetrahydroisoquinolineorganopnictogen compoundhydrocarbon derivativebenzenoidorganic nitrogen compoundaminetertiary amineorganooxygen compound |
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