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CHEBI:184698 - {4-[3-(2,5-dihydroxyphenyl)-3-oxopropyl]phenyl}oxidanesulfonic acid

ChEBI IDCHEBI:184698
ChEBI Name{4-[3-(2,5-dihydroxyphenyl)-3-oxopropyl]phenyl}oxidanesulfonic acid
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC15H14O7S
Net Charge0
Average Mass338.337
Monoisotopic Mass338.04602
SMILESO=C(CCc1ccc(OS(=O)(=O)O)cc1)c1cc(O)ccc1O
InChIInChI=1S/C15H14O7S/c16-11-4-8-15(18)13(9-11)14(17)7-3-10-1-5-12(6-2-10)22-23(19,20)21/h1-2,4-6,8-9,16,18H,3,7H2,(H,19,20,21)
InChIKeyYZGWGKYYHWFRRB-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)
{4-[3-(2,5-dihydroxyphenyl)-3-oxopropyl]phenyl}oxidanesulfonic acid (CHEBI:184698) is a chalcones (CHEBI:23086)
IUPAC Name 
[4-[3-(2,5-dihydroxyphenyl)-3-oxopropyl]phenyl] hydrogen sulate
Manual XrefsDatabases
HMDB0135378HMDB
74853811ChemSpider