Record Information |
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HMDB Status | Not Available |
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Creation Date | 2024-02-20 23:43:39 UTC |
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Update Date | 2025-03-21 17:59:49 UTC |
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HMDB ID | Not Available |
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Metabolite Identification |
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DeepMet ID | DMID00023471 |
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Frequency | 167.4 |
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Structure | |
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Chemical Formula | C14H11I4NO2 |
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Molecular Mass | 732.6969 |
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SMILES | NCCc1cc(I)c(Oc2cc(I)c(O)c(I)c2)c(I)c1 |
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InChI Key | NMRKJTPVKAFIII-UHFFFAOYSA-N |
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Chemical Taxonomy |
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Kingdom | organic compounds |
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Superclass | benzenoids |
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Class | benzene and substituted derivatives |
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Subclass | diphenylethers |
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Direct Parent | diphenylethers |
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Geometric Descriptor | aromatic homomonocyclic compounds |
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Alternative Parents | aryl iodidesdiarylethershalophenolshydrocarbon derivativesiodobenzenesmonoalkylamineso-iodophenolsorganoiodidesorganonitrogen compoundsorganopnictogen compoundsphenol ethersphenoxy compounds |
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Substituents | diaryl etherphenol etheretherorganohalogen compoundiodobenzeneorganoiodideorganonitrogen compoundorganopnictogen compound2-iodophenolaryl halidearomatic homomonocyclic compound2-halophenolorganic oxygen compoundphenolhydrocarbon derivativeprimary aliphatic aminearyl iodideorganic nitrogen compoundhalobenzenephenoxy compounddiphenyletherorganooxygen compound |
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