| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 00:21:04 UTC |
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| Update Date | 2025-03-21 18:36:54 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID00112929 |
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| Frequency | 23.5 |
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| Structure | |
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| Chemical Formula | C12H7I3O3 |
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| Molecular Mass | 579.7529 |
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| SMILES | Oc1ccc(Oc2cc(I)c(O)cc2I)cc1I |
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| InChI Key | XPNAQIDTXCGORK-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 | 1-hydroxy-2-unsubstituted benzenoidsaryl iodidesdiarylethershalophenolshydrocarbon derivativesiodobenzenesm-iodophenolso-iodophenolsorganoiodidesphenol ethersphenoxy compounds |
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| Substituents | diaryl ether3-halophenolphenol etherether2-iodophenol1-hydroxy-2-unsubstituted benzenoidorganohalogen compoundiodobenzeneorganoiodidearyl halidearomatic homomonocyclic compound2-halophenolorganic oxygen compoundphenolhydrocarbon derivativearyl iodidehalobenzenephenoxy compound3-iodophenoldiphenyletherorganooxygen compound |
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