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CHEBI:191972 - Glucoliquiritin apioside

ChEBI IDCHEBI:191972
ChEBI NameGlucoliquiritin apioside
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC32H40O18
Net Charge0
Average Mass712.654
Monoisotopic Mass712.22146
SMILESO=C1CC(c2ccc(OC3OC(CO)C(O)C(O)C3OC3OCC(O)(CO)C3O)cc2)Oc2cc(OC3OC(CO)C(O)C(O)C3O)ccc21
InChIInChI=1S/C32H40O18/c33-9-20-22(37)24(39)26(41)29(48-20)46-15-5-6-16-17(36)8-18(47-19(16)7-15)13-1-3-14(4-2-13)45-30-27(25(40)23(38)21(10-34)49-30)50-31-28(42)32(43,11-35)12-44-31/h1-7,18,20-31,33-35,37-43H,8-12H2
InChIKeyJUYBMOHJXUXKDN-UHFFFAOYSA-N
Species of MetaboliteComponentSourceComments
Populus trichocarpa (ncbitaxon:3694) root (BTO:0001188) MetaboLights (MTBLS4196)
ChEBI Ontology
Outgoing Relation(s)
Glucoliquiritin apioside (CHEBI:191972) is a flavonoids (CHEBI:72544)
Glucoliquiritin apioside (CHEBI:191972) is a glycoside (CHEBI:24400)
IUPAC Name 
2-[4-[3-[3,4-dihydroxy-4-(hydroxymethyl)oxolan-2-yl]oxy-4,5-dihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyphenyl]-7-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-2,3-dihydrochromen-4-one
Manual XrefsDatabases
HMDB0041149HMDB