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CHEBI:184919 - {3-[3-(2-hydroxyphenyl)propanoyl]phenyl}oxidanesulfonic acid

ChEBI IDCHEBI:184919
ChEBI Name{3-[3-(2-hydroxyphenyl)propanoyl]phenyl}oxidanesulfonic acid
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC15H14O6S
Net Charge0
Average Mass322.338
Monoisotopic Mass322.05111
SMILESO=C(CCc1ccccc1O)c1cccc(OS(=O)(=O)O)c1
InChIInChI=1S/C15H14O6S/c16-14-7-2-1-4-11(14)8-9-15(17)12-5-3-6-13(10-12)21-22(18,19)20/h1-7,10,16H,8-9H2,(H,18,19,20)
InChIKeyMJIBNWPUBVKPJJ-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)
{3-[3-(2-hydroxyphenyl)propanoyl]phenyl}oxidanesulfonic acid (CHEBI:184919) is a dihydrochalcones (CHEBI:71230)
IUPAC Name 
[3-[3-(2-hydroxyphenyl)propanoyl]phenyl] hydrogen sulate
Manual XrefsDatabases
HMDB0135451HMDB
74853840ChemSpider