| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 00:06:37 UTC |
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| Update Date | 2025-03-21 18:29:32 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID00078072 |
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| Frequency | 37.5 |
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| Structure | |
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| Chemical Formula | C6H5IO5S |
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| Molecular Mass | 315.8902 |
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| SMILES | O=S(=O)(O)Oc1c(O)cccc1I |
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| InChI Key | SNERUIZZIAHYRA-UHFFFAOYSA-N |
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| Chemical Taxonomy |
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| Kingdom | organic compounds |
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| Superclass | organic acids and derivatives |
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| Class | organic sulfuric acids and derivatives |
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| Subclass | arylsulfates |
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| Direct Parent | phenylsulfates |
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| Geometric Descriptor | aromatic homomonocyclic compounds |
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| Alternative Parents | 1-hydroxy-2-unsubstituted benzenoids1-hydroxy-4-unsubstituted benzenoidsaryl iodideshalophenolshydrocarbon derivativesiodobenzenesm-iodophenolsorganic oxidesorganoiodidesorganooxygen compoundsphenoxy compoundssulfuric acid monoesters |
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| Substituents | monocyclic benzene moietysulfuric acid monoester1-hydroxy-2-unsubstituted benzenoidorganohalogen compoundiodobenzeneorganoiodidephenylsulfateorganic oxide3-halophenol1-hydroxy-4-unsubstituted benzenoidaryl halidearomatic homomonocyclic compoundorganic oxygen compoundsulfate-esterphenolhydrocarbon derivativebenzenoidaryl iodidehalobenzenephenoxy compoundsulfuric acid ester3-iodophenolorganooxygen compound |
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