Record Information |
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HMDB Status | expected |
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Creation Date | 2024-02-20 23:38:30 UTC |
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Update Date | 2025-03-21 17:58:04 UTC |
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HMDB ID | HMDB0060074 |
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Metabolite Identification |
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DeepMet ID | DMID00012011 |
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Name | Reverse-triiodthyronine |
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Frequency | 381.3 |
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Structure | |
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Chemical Formula | C15H12I3NO4 |
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Molecular Mass | 650.7901 |
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SMILES | NC(Cc1ccc(Oc2cc(I)c(O)c(I)c2)c(I)c1)C(=O)O |
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InChI Key | HZCBWYNLGPIQRK-UHFFFAOYSA-N |
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Chemical Taxonomy |
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Kingdom | organic compounds |
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Superclass | organic acids and derivatives |
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Class | carboxylic acids and derivatives |
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Subclass | amino acids, peptides, and analogues |
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Direct Parent | phenylalanine and derivatives |
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Geometric Descriptor | aromatic homomonocyclic compounds |
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Alternative Parents | alpha amino acidsamphetamines and derivativesaryl iodidescarbonyl compoundscarboxylic acidsdiarylethersdiphenylethershalophenolshydrocarbon derivativesiodobenzenesmonoalkylaminesmonocarboxylic acids and derivativeso-iodophenolsorganic oxidesorganoiodidesorganonitrogen compoundsorganopnictogen compoundsphenol ethersphenoxy compoundsphenylpropanoic acids |
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Substituents | diaryl etherphenol ethermonocyclic benzene moietycarbonyl groupethercarboxylic acid3-phenylpropanoic-acidorganohalogen compoundiodobenzeneorganoiodideorganic oxideorganonitrogen compoundalpha-amino acidorganopnictogen compoundamphetamine or derivatives2-iodophenolaryl halidearomatic homomonocyclic compound2-halophenolmonocarboxylic acid or derivativesphenylalanine or derivativesorganic oxygen compoundphenolhydrocarbon derivativebenzenoidprimary aliphatic aminearyl iodideorganic nitrogen compoundhalobenzenephenoxy compounddiphenyletherorganooxygen compound |
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