Record Information |
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HMDB Status | Not Available |
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Creation Date | 2024-02-21 14:37:36 UTC |
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Update Date | 2025-03-25 00:45:37 UTC |
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HMDB ID | Not Available |
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Metabolite Identification |
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DeepMet ID | DMID02150186 |
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Frequency | 0.5 |
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Structure | |
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Chemical Formula | C14H8Cl6O |
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Molecular Mass | 401.8706 |
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SMILES | Clc1ccc(OC(c2ccccc2Cl)C(Cl)(Cl)Cl)c(Cl)c1 |
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InChI Key | VXDSKVVDQUZAHG-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 | halobenzenes |
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Direct Parent | dichlorobenzenes |
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Geometric Descriptor | aromatic homomonocyclic compounds |
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Alternative Parents | alkyl aryl ethersalkyl chloridesaryl chlorideshydrocarbon derivativesorganochloridesphenol ethersphenoxy compounds |
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Substituents | aryl chloridephenol etheretheralkyl chlorideorganochloridealkyl aryl etherorganohalogen compoundaryl halide1,3-dichlorobenzenearomatic homomonocyclic compoundorganic oxygen compoundalkyl halidehydrocarbon derivativephenoxy compoundorganooxygen compound |
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