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CHEBI:191674 - 1'-O-Galloylsucrose

ChEBI IDCHEBI:191674
ChEBI Name1'-O-Galloylsucrose
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC19H26O15
Net Charge0
Average Mass494.402
Monoisotopic Mass494.12717
SMILESO=C(OCC1(OC2OC(CO)C(O)C(O)C2O)OC(CO)C(O)C1O)c1cc(O)c(O)c(O)c1
InChIInChI=1S/C19H26O15/c20-3-9-12(25)14(27)15(28)18(32-9)34-19(16(29)13(26)10(4-21)33-19)5-31-17(30)6-1-7(22)11(24)8(23)2-6/h1-2,9-10,12-16,18,20-29H,3-5H2
InChIKeyXPQHIVBLCNQLEF-UHFFFAOYSA-N
Species of MetaboliteComponentSourceComments
Ulmus parvifolia (ncbitaxon:63058)
seed (BTO:0001226) MetaboLights (MTBLS4572)
bark (BTO:0001301) MetaboLights (MTBLS4572)
ChEBI Ontology
Outgoing Relation(s)
1'-O-Galloylsucrose (CHEBI:191674) is a gallate ester (CHEBI:37576)
IUPAC Name 
[3,4-dihydroxy-5-(hydroxymethyl)-2-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyoxolan-2-yl]methyl 3,4,5-trihydroxybenzoate
Manual XrefsDatabases
HMDB0039283HMDB