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CHEBI:185705 - {3-[2-hydroxy-3-(2,4,6-trihydroxyphenyl)propyl]phenyl}oxidanesulfonic acid

ChEBI IDCHEBI:185705
ChEBI Name{3-[2-hydroxy-3-(2,4,6-trihydroxyphenyl)propyl]phenyl}oxidanesulfonic acid
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC15H16O8S
Net Charge0
Average Mass356.352
Monoisotopic Mass356.05659
SMILESO=S(=O)(O)Oc1cccc(CC(O)Cc2c(O)cc(O)cc2O)c1
InChIInChI=1S/C15H16O8S/c16-10(6-13-14(18)7-11(17)8-15(13)19)4-9-2-1-3-12(5-9)23-24(20,21)22/h1-3,5,7-8,10,16-19H,4,6H2,(H,20,21,22)
InChIKeyYTGCFSJXFJHJGI-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-[2-hydroxy-3-(2,4,6-trihydroxyphenyl)propyl]phenyl}oxidanesulfonic acid (CHEBI:185705) is a phenols (CHEBI:33853)
IUPAC Name 
[3-[2-hydroxy-3-(2,4,6-trihydroxyphenyl)propyl]phenyl] hydrogen sulate
Manual XrefsDatabases
HMDB0127752HMDB
74852000ChemSpider