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CHEBI:88751 - Benzeneacetamide-4-O-sulphate

ChEBI IDCHEBI:88751
ChEBI NameBenzeneacetamide-4-O-sulphate
Stars
DownloadsMolfile
FormulaC8H9NO5S
Net Charge0
Average Mass231.229
Monoisotopic Mass231.02014
SMILESNC(=O)Cc1ccc(OS(=O)(=O)O)cc1
InChIInChI=1S/C8H9NO5S/c9-8(10)5-6-1-3-7(4-2-6)14-15(11,12)13/h1-4H,5H2,(H2,9,10)(H,11,12,13)
InChIKeyXPBXOWYWJUBGMF-UHFFFAOYSA-N
Species of MetaboliteComponentSourceComments
Homo sapiens (ncbitaxon:9606) urine (BTO:0001419) PubMed (22827565)
ChEBI Ontology
Outgoing Relation(s)
Benzeneacetamide-4-O-sulphate (CHEBI:88751) is a sulfuric ester (CHEBI:26819)
Synonym  Source
[4-(carbamoylmethyl)phenyl]oxidanesulfonic acidHMDB
Manual XrefsDatabases
HMDB0059994HMDB
Citations