| Record Information |
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| HMDB Status | detected |
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| Creation Date | 2024-02-20 23:33:40 UTC |
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| Update Date | 2025-03-21 17:56:12 UTC |
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| HMDB ID | HMDB0060018 |
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| Metabolite Identification |
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| DeepMet ID | DMID00000685 |
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| Name | Pyrogallol-2-O-sulphate |
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| Frequency | 8044.0 |
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| Structure | |
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| Chemical Formula | C6H6O6S |
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| Molecular Mass | 205.9885 |
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| SMILES | O=S(=O)(O)Oc1c(O)cccc1O |
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| InChI Key | XADBYTWTQXSBAF-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 benzenoidshydrocarbon derivativesorganic oxidesorganooxygen compoundsphenoxy compoundsresorcinolssulfuric acid monoesters |
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| Substituents | monocyclic benzene moietysulfuric acid monoester1-hydroxy-2-unsubstituted benzenoid1-hydroxy-4-unsubstituted benzenoidresorcinolaromatic homomonocyclic compoundphenylsulfateorganic oxideorganic oxygen compoundsulfate-esterphenolhydrocarbon derivativebenzenoidphenoxy compoundsulfuric acid esterorganooxygen compound |
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