| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 00:16:02 UTC |
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| Update Date | 2025-03-21 18:34:23 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID00100576 |
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| Frequency | 27.2 |
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| Structure | |
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| Chemical Formula | C13H9Br3O2 |
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| Molecular Mass | 433.8153 |
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| SMILES | COc1ccc(Oc2ccc(Br)cc2Br)c(Br)c1 |
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| InChI Key | OEUVVUKQYLWYRI-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 | alkyl aryl ethersanisolesaryl bromidesbromobenzenesdiarylethershydrocarbon derivativesmethoxybenzenesorganobromidesphenoxy compounds |
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| Substituents | diaryl etherphenol etheretherbromodiphenyl etherbromobenzenealkyl aryl etherorganohalogen compoundmethoxybenzenearyl halidearomatic homomonocyclic compoundorganic oxygen compoundanisoleorganobromidehydrocarbon derivativehalobenzenephenoxy compoundaryl bromideorganooxygen compound |
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