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CHEBI:6053 - Isorhapontin

ChEBI IDCHEBI:6053
ChEBI NameIsorhapontin
Stars
Last Modified28 July 2014
DownloadsMolfile
FormulaC21H24O9
Net Charge0
Average Mass420.414
Monoisotopic Mass420.14203
SMILESCOc1cc(/C=C/c2cc(O)cc(O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)c2)ccc1O
InChIInChI=1S/C21H24O9/c1-28-16-8-11(4-5-15(16)24)2-3-12-6-13(23)9-14(7-12)29-21-20(27)19(26)18(25)17(10-22)30-21/h2-9,17-27H,10H2,1H3/b3-2+/t17-,18-,19+,20-,21-/m1/s1
InChIKeyKLPUXMNQDCUPNO-DXKBKAGUSA-N
ChEBI Ontology
Outgoing Relation(s)
Isorhapontin (CHEBI:6053) is a glycoside (CHEBI:24400)
Isorhapontin (CHEBI:6053) is a stilbenoid (CHEBI:26776)
Synonym  Source
IsorhapontinKEGG COMPOUND
Manual XrefsDatabases
C10266KEGG COMPOUND
C00002887KNApSAcK
Registry NumbersSources
CAS:32727-29-0KEGG COMPOUND