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CHEBI:184576 - {[1-(2-hydroxyphenyl)-3-oxopropan-2-yl]oxy}sulfonic acid

ChEBI IDCHEBI:184576
ChEBI Name{[1-(2-hydroxyphenyl)-3-oxopropan-2-yl]oxy}sulfonic acid
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC9H10O6S
Net Charge0
Average Mass246.240
Monoisotopic Mass246.01981
SMILESO=CC(Cc1ccccc1O)OS(=O)(=O)O
InChIInChI=1S/C9H10O6S/c10-6-8(15-16(12,13)14)5-7-3-1-2-4-9(7)11/h1-4,6,8,11H,5H2,(H,12,13,14)
InChIKeyPHXNRGQRORYPBP-UHFFFAOYSA-N
Species of MetaboliteComponentSourceComments
Mus musculus (ncbitaxon:10090) feces (BTO:0000440) MetaboLights (MTBLS3750) Strain: C57BL/6 Mouse [NCIT:C14424]
ChEBI Ontology
Outgoing Relation(s)
{[1-(2-hydroxyphenyl)-3-oxopropan-2-yl]oxy}sulfonic acid (CHEBI:184576) is a phenols (CHEBI:33853)
IUPAC Name 
[1-(2-hydroxyphenyl)-3-oxopropan-2-yl] hydrogen sulate
Manual XrefsDatabases
74853566ChemSpider
HMDB0134069HMDB