Record Information |
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HMDB Status | expected |
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Creation Date | 2024-02-20 23:37:56 UTC |
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Update Date | 2025-03-21 17:57:51 UTC |
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HMDB ID | HMDB0168668 |
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Metabolite Identification |
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DeepMet ID | DMID00010677 |
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Name | Methyl-4-hydroxybenzoate sulfate |
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Frequency | 439.2 |
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Structure | |
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Chemical Formula | C8H8O6S |
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Molecular Mass | 232.0042 |
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SMILES | COC(=O)c1ccc(OS(=O)(=O)O)cc1 |
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InChI Key | IBEAHXYYSZWGED-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 | benzoic acid estersbenzoyl derivativeshydrocarbon derivativesmethyl estersmonocarboxylic acids and derivativesorganic oxidesorganooxygen compoundsphenoxy compoundssulfuric acid monoesters |
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Substituents | monocyclic benzene moietysulfuric acid monoesterbenzoylbenzoic acid or derivativesbenzoate estercarboxylic acid derivativearomatic homomonocyclic compoundphenylsulfateorganic oxidemonocarboxylic acid or derivativesmethyl esterorganic oxygen compoundcarboxylic acid estersulfate-esterhydrocarbon derivativebenzenoidphenoxy compoundsulfuric acid esterorganooxygen compound |
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