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CHEBI:191845 - Schaftoside 4'-glucoside

Default Structure
ChEBI IDCHEBI:191845
ChEBI NameSchaftoside 4'-glucoside
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC32H38O19
Net Charge0
Average Mass726.637
Monoisotopic Mass726.20073
SMILESO=c1cc(-c2ccc(OC3OC(CO)C(O)C(O)C3O)cc2)oc2c(C3OCC(O)C(O)C3O)c(O)c(C3OC(CO)C(O)C(O)C3O)c(O)c12
InChIInChI=1S/C32H38O19/c33-6-14-20(38)24(42)27(45)31(50-14)17-22(40)16-11(35)5-13(49-29(16)18(23(17)41)30-26(44)19(37)12(36)8-47-30)9-1-3-10(4-2-9)48-32-28(46)25(43)21(39)15(7-34)51-32/h1-5,12,14-15,19-21,24-28,30-34,36-46H,6-8H2
InChIKeyRQNICSULQVIVER-UHFFFAOYSA-N
Species of MetaboliteComponentSourceComments
Ulmus parvifolia (ncbitaxon:63058)
seed (BTO:0001226) MetaboLights (MTBLS4572)
bark (BTO:0001301) MetaboLights (MTBLS4572)
ChEBI Ontology
Outgoing Relation(s)
Schaftoside 4'-glucoside (CHEBI:191845) is a flavonoids (CHEBI:72544)
Schaftoside 4'-glucoside (CHEBI:191845) is a glycoside (CHEBI:24400)
IUPAC Name 
5,7-dihydroxy-6-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]-2-[4-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyphenyl]-8-(3,4,5-trihydroxyoxan-2-yl)chromen-4-one
Manual XrefsDatabases
HMDB0040878HMDB