| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 00:29:15 UTC |
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| Update Date | 2025-03-21 18:41:04 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID00132386 |
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| Frequency | 19.1 |
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| Structure | |
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| Chemical Formula | C16H15NO |
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| Molecular Mass | 237.1154 |
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| SMILES | O=C(c1ccccc1)N1CCc2ccccc2C1 |
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| InChI Key | QXUMOIJXVLZMFC-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 | isoquinolines and derivatives |
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| Subclass | benzylisoquinolines |
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| Direct Parent | benzylisoquinolines |
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| Geometric Descriptor | aromatic heteropolycyclic compounds |
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| Alternative Parents | azacyclic compoundsbenzamidesbenzoyl derivativescarboxylic acids and derivativeshydrocarbon derivativesorganic oxidesorganonitrogen compoundsorganooxygen compoundsorganopnictogen compoundstertiary carboxylic acid amidestetrahydroisoquinolines |
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| Substituents | monocyclic benzene moietyazacyclebenzoylbenzoic acid or derivativescarboxamide groupcarboxylic acid derivativebenzylisoquinolinebenzamideorganic oxideorganic oxygen compoundaromatic heteropolycyclic compoundtertiary carboxylic acid amideorganonitrogen compoundtetrahydroisoquinolineorganopnictogen compoundhydrocarbon derivativebenzenoidorganic nitrogen compoundorganooxygen compound |
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