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CHEBI:188067 - 3,4-Dihydroxychalcone 4-beta-L-arabinopyranosyl-(1->4)-galactoside

ChEBI IDCHEBI:188067
ChEBI Name3,4-Dihydroxychalcone 4-beta-L-arabinopyranosyl-(1->4)-galactoside
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC26H30O12
Net Charge0
Average Mass534.514
Monoisotopic Mass534.17373
SMILESO=C(/C=C/c1ccc(O[C@@H]2O[C@H](CO)[C@H](O[C@H]3OC[C@H](O)[C@H](O)[C@H]3O)[C@H](O)[C@H]2O)c(O)c1)c1ccccc1
InChIInChI=1S/C26H30O12/c27-11-19-24(38-25-22(33)20(31)17(30)12-35-25)21(32)23(34)26(37-19)36-18-9-7-13(10-16(18)29)6-8-15(28)14-4-2-1-3-5-14/h1-10,17,19-27,29-34H,11-12H2/b8-6+/t17-,19+,20-,21+,22+,23+,24-,25+,26+/m0/s1
InChIKeyJXPISHHFQKDJPD-ZJEJXGDJSA-N
Species of MetaboliteComponentSourceComments
Homo sapiens (ncbitaxon:9606) blood plasma (BTO:0000131) MetaboLights (MTBLS2224)
ChEBI Ontology
Outgoing Relation(s)
3,4-Dihydroxychalcone 4-beta-L-arabinopyranosyl-(1->4)-galactoside (CHEBI:188067) is a flavonoids (CHEBI:72544)
3,4-Dihydroxychalcone 4-beta-L-arabinopyranosyl-(1->4)-galactoside (CHEBI:188067) is a glycoside (CHEBI:24400)
IUPAC Name 
(E)-3-[4-[(2S,3R,4R,5R,6R)-3,4-dihydroxy-6-(hydroxymethyl)-5-[(2R,3R,4S,5S)-3,4,5-trihydroxyoxan-2-yl]oxyoxan-2-yl]oxy-3-hydroxyphenyl]-1-phenylprop-2-en-1-one
Manual XrefsDatabases
LMPK12120196LIPID MAPS
24845948ChemSpider