| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 15:16:54 UTC |
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| Update Date | 2025-03-25 00:59:53 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02239855 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C14H12Br2INO2 |
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| Molecular Mass | 510.828 |
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| SMILES | NCCc1cc(Br)c(Oc2ccc(O)c(Br)c2)c(I)c1 |
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| InChI Key | RNFZVXTVRJITRZ-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 | bromodiphenyl ethers |
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| Geometric Descriptor | aromatic homomonocyclic compounds |
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| Alternative Parents | 1-hydroxy-2-unsubstituted benzenoidsaryl bromidesaryl iodidesbromobenzenesdiarylethershalophenolshydrocarbon derivativesiodobenzenesmonoalkylamineso-bromophenolsorganobromidesorganoiodidesorganonitrogen compoundsorganopnictogen compoundsphenol ethersphenoxy compounds |
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| Substituents | diaryl etherphenol etheretherbromodiphenyl ether1-hydroxy-2-unsubstituted benzenoidorganohalogen compoundiodobenzeneorganoiodideorganonitrogen compoundorganopnictogen compound2-bromophenolbromobenzenearyl halidearomatic homomonocyclic compound2-halophenolorganic oxygen compoundorganobromidephenolhydrocarbon derivativeprimary aliphatic aminearyl iodideorganic nitrogen compoundhalobenzenephenoxy compoundaryl bromideorganooxygen compound |
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