4-ethylphenyl sulfate (CHEBI:82932)

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ChEBI Name	4-ethylphenyl sulfate

ChEBI ID	CHEBI:82932

Definition	An aryl sulfate that is 4-ethylphenol in which the hydroxy group has been replaced by a sulfooxy group.

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

Supplier Information

Download	Molfile XML SDF

Formula

C8H10O4S

Net Charge

Average Mass

202.22800

Monoisotopic Mass

202.02998

InChI

InChI=1S/C8H10O4S/c1-2-7-3-5-8(6-4-7)12-13(9,10)11/h3-6H,2H2,1H3,(H,9,10,11)

InChIKey

DWZGLEPNCRFCEP-UHFFFAOYSA-N

SMILES

CCc1ccc(OS(O)(=O)=O)cc1

Metabolite of Species	Details
Homo sapiens (NCBI:txid9606)	See: PubMed

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	4-ethylphenyl sulfate (CHEBI:82932) has functional parent 4-ethylphenol (CHEBI:49584) 4-ethylphenyl sulfate (CHEBI:82932) has role gut flora metabolite (CHEBI:82933) 4-ethylphenyl sulfate (CHEBI:82932) has role human metabolite (CHEBI:77746) 4-ethylphenyl sulfate (CHEBI:82932) has role uremic toxin (CHEBI:64584) 4-ethylphenyl sulfate (CHEBI:82932) is a aryl sulfate (CHEBI:37919) 4-ethylphenyl sulfate (CHEBI:82932) is a benzenes (CHEBI:22712) 4-ethylphenyl sulfate (CHEBI:82932) is conjugate acid of 4-ethylphenyl sulfate(1−) (CHEBI:133681)

Incoming	4-ethylphenyl sulfate(1−) (CHEBI:133681) is conjugate base of 4-ethylphenyl sulfate (CHEBI:82932)

IUPAC Name

4-ethylphenyl hydrogen sulfate

Registry Number	Type	Source
2450312	Reaxys Registry Number	Reaxys

Last Modified

08 January 2021