| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 00:24:24 UTC |
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| Update Date | 2025-03-21 18:38:28 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID00120931 |
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| Frequency | 21.5 |
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| Structure | |
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| Chemical Formula | C8H6I2O4 |
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| Molecular Mass | 419.8356 |
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| SMILES | O=C(O)C(O)c1cc(I)c(O)c(I)c1 |
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| InChI Key | RAYVYAAJNUEVIF-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 | phenols |
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| Subclass | halophenols |
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| Direct Parent | halophenols |
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| Geometric Descriptor | aromatic homomonocyclic compounds |
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| Alternative Parents | alpha hydroxy acids and derivativesaromatic alcoholsaryl iodidescarbonyl compoundscarboxylic acidshydrocarbon derivativesiodobenzenesmonocarboxylic acids and derivativeso-iodophenolsorganic oxidesorganoiodidessecondary alcohols |
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| Substituents | aromatic alcoholmonocyclic benzene moietycarbonyl groupcarboxylic acidalpha-hydroxy acidcarboxylic acid derivativeorganohalogen compoundiodobenzeneorganoiodideorganic oxidealcohol2-iodophenolhydroxy acidaryl halidearomatic homomonocyclic compound2-halophenolmonocarboxylic acid or derivativesorganic oxygen compoundsecondary alcoholhydrocarbon derivativearyl iodidehalobenzeneorganooxygen compound |
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