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CHEBI:193458 - {3-[3-(3,4-dihydroxyphenyl)-3-oxopropyl]phenyl}oxidanesulfonic acid

ChEBI IDCHEBI:193458
ChEBI Name{3-[3-(3,4-dihydroxyphenyl)-3-oxopropyl]phenyl}oxidanesulfonic acid
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC15H14O7S
Net Charge0
Average Mass338.337
Monoisotopic Mass338.04602
SMILESO=C(CCc1cccc(OS(=O)(=O)O)c1)c1ccc(O)c(O)c1
InChIInChI=1S/C15H14O7S/c16-13(11-5-7-14(17)15(18)9-11)6-4-10-2-1-3-12(8-10)22-23(19,20)21/h1-3,5,7-9,17-18H,4,6H2,(H,19,20,21)
InChIKeyBJQPCPCQKQAKRW-UHFFFAOYSA-N
Species of MetaboliteComponentSourceComments
Homo sapiens (ncbitaxon:9606) feces (BTO:0000440) MetaboLights (MTBLS5335)
ChEBI Ontology
Outgoing Relation(s)
{3-[3-(3,4-dihydroxyphenyl)-3-oxopropyl]phenyl}oxidanesulfonic acid (CHEBI:193458) is a dihydrochalcones (CHEBI:71230)
IUPAC Name 
[3-[3-(3,4-dihydroxyphenyl)-3-oxopropyl]phenyl] hydrogen sulate
Manual XrefsDatabases
74853835ChemSpider