| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 14:52:23 UTC |
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| Update Date | 2025-03-25 00:50:57 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02183906 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C9H7I2NO2 |
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| Molecular Mass | 414.8566 |
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| SMILES | O=C1CCc2cc(I)c(O)c(I)c2N1 |
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| InChI Key | SXIASXGLXQSTJL-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 | quinolines and derivatives |
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| Subclass | quinolones and derivatives |
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| Direct Parent | hydroquinolones |
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| Geometric Descriptor | aromatic heteropolycyclic compounds |
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| Alternative Parents | aryl iodidesazacyclic compoundsbenzenoidscarbonyl compoundscarboxylic acids and derivativeshydrocarbon derivativeshydroquinolineslactamso-iodophenolsorganic oxidesorganoiodidesorganonitrogen compoundsorganopnictogen compoundssecondary carboxylic acid amides |
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| Substituents | carbonyl grouplactamcarboxylic acid derivativeorganohalogen compoundorganoiodideorganic oxidearomatic heteropolycyclic compoundorganonitrogen compoundorganopnictogen compoundtetrahydroquinolinetetrahydroquinoloneazacycle2-iodophenolcarboxamide grouparyl halidesecondary carboxylic acid amideorganic oxygen compoundhydrocarbon derivativebenzenoidaryl iodideorganic nitrogen compoundorganooxygen compound |
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