p-cresol sulfate(1-) (CHEBI:133670)

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ChEBI Name	p-cresol sulfate(1−)

ChEBI ID	CHEBI:133670

ChEBI ASCII Name	p-cresol sulfate(1-)

Definition	A phenyl sulfate oxoanion that is the conjugate base of p-cresol sulfate, obtained by deprotonation of the sulfate group; major species at pH 7.3.

Stars	This entity has been manually annotated by the ChEBI Team.

Supplier Information

Download	Molfile XML SDF

Formula

C7H7O4S

Net Charge

-1

Average Mass

187.194

Monoisotopic Mass

187.00705

InChI

InChI=1S/C7H8O4S/c1-6-2-4-7(5-3-6)11-12(8,9)10/h2-5H,1H3,(H,8,9,10)/p-1

InChIKey

WGNAKZGUSRVWRH-UHFFFAOYSA-M

SMILES

C=1(C=CC(OS([O-])(=O)=O)=CC1)C

Roles Classification
Biological Role(s):	human metabolite Any mammalian metabolite produced during a metabolic reaction in humans (Homo sapiens). uremic toxin A toxin that accumulates in patients with chronic kidney disease. gut flora metabolite Metabolites produced by the gut microbiota or microorganisms (e.g. bacteria and fungi) that live in the digestive tracts of animals.

ChEBI Ontology
Outgoing	p-cresol sulfate(1−) (CHEBI:133670) has role gut flora metabolite (CHEBI:82933) p-cresol sulfate(1−) (CHEBI:133670) has role human metabolite (CHEBI:77746) p-cresol sulfate(1−) (CHEBI:133670) has role uremic toxin (CHEBI:64584) p-cresol sulfate(1−) (CHEBI:133670) is a phenyl sulfate oxoanion (CHEBI:140317) p-cresol sulfate(1−) (CHEBI:133670) is conjugate base of p-cresol sulfate (CHEBI:82914)

Incoming	p-cresol sulfate (CHEBI:82914) is conjugate acid of p-cresol sulfate(1−) (CHEBI:133670)

IUPAC Name

4-methylphenyl sulfate

Registry Number	Type	Source
3668793	Reaxys Registry Number	Reaxys

Last Modified

04 April 2018