| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 15:21:22 UTC |
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| Update Date | 2025-03-25 01:01:34 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02250256 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C15H14N2O2 |
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| Molecular Mass | 254.1055 |
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| SMILES | O=C(c1ccc[nH]c1=O)N1CCc2ccccc2C1 |
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| InChI Key | JGIHXTJJVSBNNF-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 | azacyclic compoundsbenzenoidscarboxylic acids and derivativesheteroaromatic compoundshydrocarbon derivativeslactamsorganic oxidesorganonitrogen compoundsorganooxygen compoundsorganopnictogen compoundspyridinecarboxylic acids and derivativespyridinonestertiary carboxylic acid amidesvinylogous amides |
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| Substituents | pyridine carboxylic acid or derivativesvinylogous amidelactamazacycleheteroaromatic compoundcarboxamide groupcarboxylic acid derivativeorganic oxidepyridineorganic oxygen compoundaromatic heteropolycyclic compoundtertiary carboxylic acid amideorganonitrogen compoundtetrahydroisoquinolineorganopnictogen compoundhydrocarbon derivativebenzenoidorganic nitrogen compoundpyridinoneorganooxygen compound |
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