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CHEBI:182262 - Phenethyl sophoroside

ChEBI IDCHEBI:182262
ChEBI NamePhenethyl sophoroside
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FormulaC20H30O11
Net Charge0
Average Mass446.449
Monoisotopic Mass446.17881
SMILESOC[C@H]1O[C@@H](O[C@H]2[C@H](OCCc3ccccc3)O[C@H](CO)[C@@H](O)[C@@H]2O)[C@H](O)[C@@H](O)[C@@H]1O
InChIInChI=1S/C20H30O11/c21-8-11-13(23)15(25)17(27)19(29-11)31-18-16(26)14(24)12(9-22)30-20(18)28-7-6-10-4-2-1-3-5-10/h1-5,11-27H,6-9H2/t11-,12-,13-,14-,15+,16+,17-,18-,19+,20-/m1/s1
InChIKeyBSSIFJHEGYUPRJ-HNCKFYPBSA-N
ChEBI Ontology
Outgoing Relation(s)
Phenethyl sophoroside (CHEBI:182262) is a glycoside (CHEBI:24400)
IUPAC Name 
(2S,3R,4S,5S,6R)-2-[(2R,3R,4S,5S,6R)-4,5-dihydroxy-6-(hydroxymethyl)-2-(2-phenylethoxy)oxan-3-yl]oxy-6-(hydroxymethyl)oxane-3,4,5-triol
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29814198ChemSpider