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CHEBI:175996 - Pinostilbenoside

ChEBI IDCHEBI:175996
ChEBI NamePinostilbenoside
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FormulaC21H24O8
Net Charge0
Average Mass404.415
Monoisotopic Mass404.14712
SMILESCOc1cc(O)cc(/C=C/c2ccc(O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)cc2)c1
InChIInChI=1S/C21H24O8/c1-27-16-9-13(8-14(23)10-16)3-2-12-4-6-15(7-5-12)28-21-20(26)19(25)18(24)17(11-22)29-21/h2-10,17-26H,11H2,1H3/b3-2+/t17-,18-,19+,20-,21-/m1/s1
InChIKeyIIISUZGWBIPYEJ-DXKBKAGUSA-N
ChEBI Ontology
Outgoing Relation(s)
Pinostilbenoside (CHEBI:175996) is a glycoside (CHEBI:24400)
Pinostilbenoside (CHEBI:175996) is a stilbenoid (CHEBI:26776)
IUPAC Name 
(2S,3R,4S,5S,6R)-2-[4-[(E)-2-(3-hydroxy-5-methoxyphenyl)ethenyl]phenoxy]-6-(hydroxymethyl)oxane-3,4,5-triol
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