| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-20 23:42:43 UTC |
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| Update Date | 2025-03-21 17:59:30 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID00021390 |
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| Frequency | 187.2 |
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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)c(I)c2)cc1 |
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| InChI Key | CNTXGQQXTLLCFU-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 derivativesiodobenzeneso-iodophenolsorganoiodidesphenol ethersphenoxy compounds |
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| Substituents | diaryl etherphenol etherether2-iodophenol1-hydroxy-2-unsubstituted benzenoidorganohalogen compoundiodobenzeneorganoiodidearyl halidearomatic homomonocyclic compound2-halophenolorganic oxygen compoundphenolhydrocarbon derivativearyl iodidehalobenzenephenoxy compounddiphenyletherorganooxygen compound |
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