| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-20 23:48:00 UTC |
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| Update Date | 2025-03-21 18:01:36 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID00033730 |
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| Frequency | 107.3 |
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| Structure | |
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| Chemical Formula | C12H9IO3 |
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| Molecular Mass | 327.9596 |
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| SMILES | Oc1ccc(Oc2ccc(O)cc2I)cc1 |
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| InChI Key | SPXJPEPQKWDXBZ-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-iodophenolsorganoiodidesphenol ethersphenoxy compounds |
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| Substituents | diaryl ether3-halophenolphenol etherether1-hydroxy-2-unsubstituted benzenoidorganohalogen compoundiodobenzeneorganoiodidearyl halidearomatic homomonocyclic compoundorganic oxygen compoundphenolhydrocarbon derivativearyl iodidehalobenzenephenoxy compound3-iodophenoldiphenyletherorganooxygen compound |
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