Details of Metabolite

General Information of MET (ID: META00754)
Name Methyl-4-hydroxybenzoate sulfate
Synonyms   Click to Show/Hide Synonyms of This Metabolite
Methyl-4-hydroxybenzoate O-sulfate; Methyl-4-hydroxybenzoate O-sulphate; Methyl-4-hydroxybenzoate monosulfate; Methyl-4-hydroxybenzoate monosulphate; Methyl-4-hydroxybenzoate sulfate; Methyl-4-hydroxybenzoate sulphate; Methyl-4-hydroxybenzoic acid O-sulfuric acid; Methyl-4-hydroxybenzoic acid O-sulphuric acid; Methyl-4-hydroxybenzoic acid sulfuric acid; Methyl-4-hydroxybenzoic acid sulphuric acid
Source Aromatic homomonocyclic compounds
Structure Type   Arylsulfates  (Click to Show/Hide the Complete Structure Type Hierarchy)
Organic acids and derivatives
Organic sulfuric acids and derivatives
Arylsulfates
PubChem CID
122164837
HMDB ID
HMDB0168668
Formula
C8H8O6S
Structure
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3D MOL 2D MOL
  Click to Show/Hide the Molecular/Functional Data (External Links/Property/Function) of This Metabolite
ChEBI ID
133532
ChemSpider ID
58170412
Physicochemical Properties Molecular Weight 232.21 Topological Polar Surface Area 98.3
XlogP 1.3 Complexity 309
Heavy Atom Count 15 Rotatable Bond Count 4
Hydrogen Bond Donor Count 1 Hydrogen Bond Acceptor Count 6
Function
Methyl-4-hydroxybenzoate sulfate belongs to the class of organic compounds known as phenylsulfates. Phenylsulfates are compounds containing a sulfuric acid group conjugated to a phenyl group. Methyl-4-hydroxybenzoate sulfate has been identified in the human placenta.
Regulatory Network
Full List of Protein(s) Regulating This Metabolite
      Apolipoprotein (Apo)
            Apolipoprotein A-II (APOA2) Click to Show/Hide the Full List of Regulating Pair(s):   1 Pair(s)
               Detailed Information Protein   Info click to show the details of this protein
               Regulating Pair Experim Info click to show the details of experiment for validating this pair [1]
                      Introduced Variation Mutation (-265T >C(rs5082)) of APOA2
                      Induced Change Methyl-4-hydroxybenzoate sulfate concentration: decrease (FC = 0.90)
                      Summary Introduced Variation         Induced Change 
                      Disease Status Obesity [ICD-11: 5B81]
                      Details It is reported that mutation (-265T >C(rs5082)) of APOA2 leads to the decrease of methyl-4-hydroxybenzoate sulfate levels compared with control group.
References
1 Epigenomics and metabolomics reveal the mechanism of the APOA2-saturated fat intake interaction affecting obesity. Am J Clin Nutr. 2018 Jul 1;108(1):188-200.

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