| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 14:50:59 UTC |
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| Update Date | 2025-03-25 00:50:25 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02180764 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C16H21N3O2 |
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| Molecular Mass | 287.1634 |
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| SMILES | COc1cc2c(cc1O)C(Cc1cncn1C)N(C)CC2 |
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| InChI Key | NDOSUVJQCAMZHM-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 benzenoidsalkyl aryl ethersanisolesaralkylaminesazacyclic compoundsheteroaromatic compoundshydrocarbon derivativesimidazolesn-substituted imidazolesorganopnictogen compoundstrialkylamines |
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| Substituents | phenol etherether1-hydroxy-2-unsubstituted benzenoidalkyl aryl etheraralkylaminearomatic heteropolycyclic compoundimidazoleorganonitrogen compoundtetrahydroisoquinolineorganopnictogen compoundtertiary amineazolen-substituted imidazoleazacycleheteroaromatic compoundtertiary aliphatic amineorganic oxygen compoundanisolehydrocarbon derivativebenzenoidorganic nitrogen compoundamineorganooxygen compound |
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