| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 14:44:35 UTC |
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| Update Date | 2025-03-25 00:48:06 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02166078 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C16H16INO2 |
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| Molecular Mass | 381.0226 |
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| SMILES | CC1NCCc2cc(Oc3ccc(O)cc3)c(I)cc21 |
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| InChI Key | UYSOVTNPZVLOGX-UHFFFAOYSA-N |
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| Chemical Taxonomy |
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| Kingdom | organic compounds |
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| Superclass | organic oxygen compounds |
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| Class | organooxygen compounds |
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| Subclass | ethers |
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| Direct Parent | diarylethers |
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| Geometric Descriptor | aromatic heteropolycyclic compounds |
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| Alternative Parents | 1-hydroxy-2-unsubstituted benzenoidsaryl iodidesazacyclic compoundsdialkylamineshydrocarbon derivativesorganoiodidesorganopnictogen compoundsphenol ethersphenoxy compoundstetrahydroisoquinolines |
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| Substituents | diaryl etherphenol ethermonocyclic benzene moiety1-hydroxy-2-unsubstituted benzenoidorganohalogen compoundorganoiodidearomatic heteropolycyclic compoundorganonitrogen compoundtetrahydroisoquinolineorganopnictogen compoundorganoheterocyclic compoundsecondary aliphatic amineazacyclesecondary aminearyl halidephenolhydrocarbon derivativebenzenoidaryl iodideorganic nitrogen compoundphenoxy compoundamine |
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