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CHEBI:140129 - 7,8,4'-trihydroxy-3',5'-dimethoxyflavanone 4'-O-glucoside

Default Structure
ChEBI IDCHEBI:140129
ChEBI Name7,8,4'-trihydroxy-3',5'-dimethoxyflavanone 4'-O-glucoside
Stars
ASCII Name7,8,4'-trihydroxy-3',5'-dimethoxyflavanone 4'-O-glucoside
Last Modified13 February 2018
Submittermwilliams
DownloadsMolfile
FormulaC23H26O12
Net Charge0
Average Mass494.449
Monoisotopic Mass494.14243
SMILESCOc1cc(C2CC(=O)c3ccc(O)c(O)c3O2)cc(OC)c1OC1OC(CO)C(O)C(O)C1O
InChIInChI=1S/C23H26O12/c1-31-14-5-9(13-7-12(26)10-3-4-11(25)17(27)21(10)33-13)6-15(32-2)22(14)35-23-20(30)19(29)18(28)16(8-24)34-23/h3-6,13,16,18-20,23-25,27-30H,7-8H2,1-2H3
InChIKeyPZCWNNWPQYVBEG-UHFFFAOYSA-N
ChEBI Ontology
Outgoing Relation(s)
7,8,4'-trihydroxy-3',5'-dimethoxyflavanone 4'-O-glucoside (CHEBI:140129) is a flavonoids (CHEBI:72544)
7,8,4'-trihydroxy-3',5'-dimethoxyflavanone 4'-O-glucoside (CHEBI:140129) is a glycoside (CHEBI:24400)
Manual XrefsDatabases
LMPK12140098LIPID MAPS