| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 15:09:55 UTC |
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| Update Date | 2025-03-25 00:57:22 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02224276 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C20H22N2O |
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| Molecular Mass | 306.1732 |
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| SMILES | O=C(C1CCCN1)N1Cc2ccccc2C(c2ccccc2)C1 |
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| InChI Key | OFRQYNLZAOOREV-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 | 4-phenyltetrahydroisoquinolines |
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| Direct Parent | 4-phenyltetrahydroisoquinolines |
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| Geometric Descriptor | aromatic heteropolycyclic compounds |
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| Alternative Parents | alpha amino acid amidesalpha amino acidsazacyclic compoundsbenzene and substituted derivativescarbonyl compoundscarboxylic acids and derivativesdialkylamineshydrocarbon derivativesorganic oxidesorganopnictogen compoundspyrrolidinecarboxamidestertiary carboxylic acid amides |
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| Substituents | monocyclic benzene moietycarbonyl groupamino acid or derivativesalpha-amino acid or derivativescarboxylic acid derivativeorganic oxidearomatic heteropolycyclic compoundtertiary carboxylic acid amideorganonitrogen compoundalpha-amino acidorganopnictogen compoundpyrrolidinesecondary aliphatic aminealpha-amino acid amideazacyclesecondary aminecarboxamide grouppyrrolidine carboxylic acid or derivatives4-phenyltetrahydroisoquinolineorganic oxygen compoundhydrocarbon derivativebenzenoidorganic nitrogen compoundpyrrolidine-2-carboxamideorganooxygen compoundamine |
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