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HYDROQUINONE SULFATE

HYDROQUINONE SULFATE

Hydroquinone sulfate is an organosulfonate oxoanion that is the conjugate base of quinol sulfate, obtained by deprotonation of the sulfo group; major species at pH 7.3. 
Hydroquinone sulfate has a role as a marine xenobiotic metabolite. 
Hydroquinone sulfate is a conjugate base of a quinol sulfate.


CAS: 17438-29-8

IUPAC Name: (4-hydroxyphenyl) sulfate

Molecular Weight: 189.17 g/mol
Molecular Formula: C6H5O5S-

hydroquinone sulfate, quinol sulfate(1-), 4-hydroxyphenyl sulfate, (4-hydroxyphenyl) sulfate, 1,4-benzenediol monosulfate, CHEBI:133073, Quinol sulfate, 4-hydroxyphenyl hydrogen sulfate, 17438-29-8, hydroquinone monosulfate, (4-hydroxyphenyl) hydrogen sulfate, Hydroquinone mono(hydrogen sulfate), hydroquinone sulfate, 1,4-Benzenediol, mono(hydrogen sulfate), quinol monosulfate, P938AXP4T2, CHEBI:71062, 1,4-Benzenediol, sulfate, UNII-P938AXP4T2, 61162-95-6, hydroquinone sulphate, P-HYDROXYPHENYL SULFATE, SCHEMBL232089, DTXSID50893525, MFCD19705194, HYDROQUINONE, HYDROGEN SULFATE, SY345645, HYDROQUINONE, MONO(HYDROGEN SULFATE), 1,4-BENZENEDIOL, 1-(HYDROGEN SULFATE), Q27139289


Hydroquinone sulfate belongs to the class of organic compounds known as phenylsulfates.
Phenylsulfates are compounds containing a sulfuric acid group conjugated to a phenyl group. 
Hydroquinone sulfate is a secondary metabolite. 
Secondary metabolites are metabolically or physiologically non-essential metabolites that may serve a role as defense or signalling molecules. 
In some cases they are simply molecules that arise from the incomplete metabolism of other secondary metabolites. 
Based on a literature review a small amount of articles have been published on Hydroquinone sulfate.


Hydroquinone sulfate is an aryl sulfate that is quinol (hydroquinone) with one of the two hydroxy groups substituted by a sulfo group.

Hydroquinone sulfate is an aryl sulfate that is quinol (hydroquinone) with one of the two hydroxy groups substituted by a sulfo group. 
Hydroquinone sulfate has a role as a human xenobiotic metabolite and a marine xenobiotic metabolite. 
Hydroquinone sulfate is an aryl sulfate and a member of phenols. 
Hydroquinone sulfate is functionally related to a hydroquinone. 
Hydroquinone sulfate is a conjugate acid of a quinol sulfate(1-).

Hydroquinone sulfate is an organosulfonate oxoanion that is the conjugate base of quinol sulfate, obtained by deprotonation of the sulfo group; major species at pH 7.3. 
Hydroquinone sulfate has a role as a marine xenobiotic metabolite. 
Hydroquinone sulfate is a conjugate base of a quinol sulfate.

Biological Role(s):    
marine xenobiotic metabolite
Any metabolite produced by metabolism of a xenobiotic compound in marine macro- and microorganisms.

human xenobiotic metabolite
Any human metabolite produced by metabolism of a xenobiotic compound in humans.

Properties

Density: 1.669
Precise Quality: 189.99400
PSA: 92.21000
logP: 1.65460

Hydroquinone sulfate is an aryl sulfate that is quinol (hydroquinone) with one of the two hydroxy groups substituted by a sulfo group. 
Hydroquinone sulfate has a role as a human xenobiotic metabolite and a marine xenobiotic metabolite. 
Hydroquinone sulfate is an aryl sulfate and a member of phenols. 
Hydroquinone sulfate derives from a hydroquinone. 
Hydroquinone sulfate is a conjugate acid of a quinol sulfate(1-).


Computational chemical data

Molecular Weight: 190.17400g/mol
Molecular Formula: C6H6O5S
Compound Is Canonicalized: True
XLogP3-AA: 0.6
Exact Mass: 189.99359446
Monoisotopic Mass: 189.99359446
Complexity: 221
Rotatable Bond Count: 2
Hydrogen Bond Donor Count: 2
Hydrogen Bond Acceptor Count: 5
Topological Polar Surface Area: 92.2
Heavy Atom Count: 12
Defined Atom Stereocenter Count: 0
Undefined Atom Stereocenter Count: 0
Defined Bond Stereocenter Count: 0
Undefined Bond Stereocenter Count: 0
Isotope Atom Count: 0
Covalently-Bonded Unit Count: 1


 

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