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CHEBI:229891 - {2-hydroxy-5-[3-(2-hydroxyphenyl)propanoyl]phenyl}oxidanesulfonic acid

ChEBI IDCHEBI:229891
ChEBI Name{2-hydroxy-5-[3-(2-hydroxyphenyl)propanoyl]phenyl}oxidanesulfonic acid
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC15H14O7S
Net Charge0
Average Mass338.337
Monoisotopic Mass338.04602
SMILESO=C(CCc1ccccc1O)c1ccc(O)c(OS(=O)(=O)O)c1
InChIInChI=1S/C15H14O7S/c16-12-4-2-1-3-10(12)5-7-13(17)11-6-8-14(18)15(9-11)22-23(19,20)21/h1-4,6,8-9,16,18H,5,7H2,(H,19,20,21)
InChIKeyPTDHJOJJMFEZCG-UHFFFAOYSA-N
Species of MetaboliteComponentSourceComments
Homo sapiens (ncbitaxon:9606) feces (BTO:0000440) MetaboLights (MTBLS9087)
ChEBI Ontology
Outgoing Relation(s)
{2-hydroxy-5-[3-(2-hydroxyphenyl)propanoyl]phenyl}oxidanesulfonic acid (CHEBI:229891) is a dihydrochalcones (CHEBI:71230)
IUPAC Name 
[2-hydroxy-5-[3-(2-hydroxyphenyl)propanoyl]phenyl] hydrogen sulate
Manual XrefsDatabases
74853828ChemSpider