| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 14:41:33 UTC |
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| Update Date | 2025-03-25 00:47:04 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02159198 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C13H10BrIO2 |
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| Molecular Mass | 403.8909 |
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| SMILES | OCc1ccc(Oc2ccc(Br)cc2)c(I)c1 |
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| InChI Key | ZSMKLDTVAMYHPG-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 | aromatic alcoholsaryl bromidesaryl iodidesbenzyl alcoholsbromobenzenesdiarylethershydrocarbon derivativesiodobenzenesorganobromidesorganoiodidesphenol ethersphenoxy compounds |
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| Substituents | aromatic alcoholdiaryl etherphenol etheretherbromodiphenyl etherorganohalogen compoundiodobenzeneorganoiodidealcoholbromobenzenebenzyl alcoholaryl halidearomatic homomonocyclic compoundorganic oxygen compoundorganobromidehydrocarbon derivativearyl iodidehalobenzenephenoxy compoundaryl bromideorganooxygen compound |
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