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CHEBI:182372 - 4-Allyl-o-phenylenebis(beta-D-glucopyranoside)

ChEBI IDCHEBI:182372
ChEBI Name4-Allyl-o-phenylenebis(beta-D-glucopyranoside)
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SubmitterMetaboLights
DownloadsMolfile
FormulaC21H30O12
Net Charge0
Average Mass474.459
Monoisotopic Mass474.17373
SMILESC=CCc1ccc(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)c(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)c1
InChIInChI=1S/C21H30O12/c1-2-3-9-4-5-10(30-20-18(28)16(26)14(24)12(7-22)32-20)11(6-9)31-21-19(29)17(27)15(25)13(8-23)33-21/h2,4-6,12-29H,1,3,7-8H2/t12-,13-,14-,15-,16+,17+,18-,19-,20-,21-/m1/s1
InChIKeySFQLDKSMEHBZRN-LWZURRPWSA-N
ChEBI Ontology
Outgoing Relation(s)
4-Allyl-o-phenylenebis(beta-D-glucopyranoside) (CHEBI:182372) is a glycoside (CHEBI:24400)
IUPAC Name 
(2R,3S,4S,5R,6S)-2-(hydroxymethyl)-6-[4-prop-2-enyl-2-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyphenoxy]oxane-3,4,5-triol
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