| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 13:55:55 UTC |
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| Update Date | 2025-03-25 00:30:36 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02052376 |
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| Frequency | 0.6 |
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| Structure | |
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| Chemical Formula | C15H9I5O5 |
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| Molecular Mass | 903.5674 |
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| SMILES | O=C(O)C(O)Cc1cc(I)c(Oc2cc(I)c(O)c(I)c2I)c(I)c1 |
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| InChI Key | CXYVWMBISUVMRP-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 | alpha hydroxy acids and derivativesaryl iodidescarbonyl compoundscarboxylic acidsdiarylethershalophenolshydrocarbon derivativesiodobenzenesm-iodophenolsmonocarboxylic acids and derivativeso-iodophenolsorganic oxidesorganoiodidesphenol ethersphenoxy compoundsphenylpropanoic acidssecondary alcohols |
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| Substituents | diaryl etherphenol ethercarbonyl groupethercarboxylic acid3-phenylpropanoic-acidalpha-hydroxy acidcarboxylic acid derivativeorganohalogen compoundiodobenzeneorganoiodideorganic oxidealcohol3-halophenol2-iodophenolhydroxy acidaryl halidearomatic homomonocyclic compound2-halophenolmonocarboxylic acid or derivativesorganic oxygen compoundsecondary alcoholphenolhydrocarbon derivativearyl iodidehalobenzenephenoxy compound3-iodophenoldiphenyletherorganooxygen compound |
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