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CHEBI:184184 - {[3,4,5-trihydroxy-6-(2,4,6-trihydroxyphenyl)oxan-2-yl]methoxy}sulfonic acid

ChEBI IDCHEBI:184184
ChEBI Name{[3,4,5-trihydroxy-6-(2,4,6-trihydroxyphenyl)oxan-2-yl]methoxy}sulfonic acid
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC12H16O11S
Net Charge0
Average Mass368.316
Monoisotopic Mass368.04133
SMILESO=S(=O)(O)OCC1OC(c2c(O)cc(O)cc2O)C(O)C(O)C1O
InChIInChI=1S/C12H16O11S/c13-4-1-5(14)8(6(15)2-4)12-11(18)10(17)9(16)7(23-12)3-22-24(19,20)21/h1-2,7,9-18H,3H2,(H,19,20,21)
InChIKeyWNLCHJYLEPZOTR-UHFFFAOYSA-N
Species of MetaboliteComponentSourceComments
Mus musculus (ncbitaxon:10090) serum (BTO:0001239) MetaboLights (MTBLS3725)
ChEBI Ontology
Outgoing Relation(s)
{[3,4,5-trihydroxy-6-(2,4,6-trihydroxyphenyl)oxan-2-yl]methoxy}sulfonic acid (CHEBI:184184) is a glycoside (CHEBI:24400)
IUPAC Name 
[3,4,5-trihydroxy-6-(2,4,6-trihydroxyphenyl)oxan-2-yl]methyl hydrogen sulate
Manual XrefsDatabases
HMDB0132678HMDB