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CHEBI:133225 - 4-acetylphenyl sulfate

ChEBI IDCHEBI:133225
ChEBI Name4-acetylphenyl sulfate
Stars
DefinitionA phenyl sulfate oxoanion that is the conjugate base of 4-acetylphenyl hydrogen sulfate, obtained by deprotonation of the sulfo group; major species at pH 7.3.
Last Modified4 April 2018
SubmitterSteve
DownloadsMolfile
FormulaC8H7O5S
Net Charge-1
Average Mass215.206
Monoisotopic Mass215.00197
SMILESCC(=O)c1ccc(OS(=O)(=O)[O-])cc1
InChIInChI=1S/C8H8O5S/c1-6(9)7-2-4-8(5-3-7)13-14(10,11)12/h2-5H,1H3,(H,10,11,12)/p-1
InChIKeyHOFGLAYWQRGTKC-UHFFFAOYSA-M
ChEBI Ontology
Outgoing Relation(s)
4-acetylphenyl sulfate (CHEBI:133225) is a phenyl sulfate oxoanion (CHEBI:140317)
4-acetylphenyl sulfate (CHEBI:133225) is conjugate base of 4-acetylphenyl hydrogen sulfate (CHEBI:133226)
Incoming Relation(s)
4-acetylphenyl hydrogen sulfate (CHEBI:133226) is conjugate acid of 4-acetylphenyl sulfate (CHEBI:133225)
Synonyms  Source
4-acetylphenol sulfateChEBI
p-acetylphenyl sulfateChEBI
p-acetylphenol sulfateChEBI