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M  END
> <ID>
CHEBI:17019

> <NAME>
(R)-amygdalin

> <DEFINITION>
An amygdalin in which the stereocentre on the cyanohydrin function has R-configuration.

> <STAR>
3

> <SECONDARY_ID>
CHEBI:18681; CHEBI:10997; CHEBI:336

> <SYNONYM>
D-mandelonitrile-beta-D-glucosido-6-beta-D-glucoside; D-amygdalin; D-(-)-mandelonitrile-beta-D-gentiobioside; (R)-Laenitrile; (R)-Amygdaloside; (R)-amygdalin; (R)-Amygdalin; (-)-D-mandelonitrile beta-D-gentiobioside

> <IUPAC_NAME>
(2R)-[(6-O-beta-D-glucopyranosyl-beta-D-glucopyranosyl)oxy](phenyl)acetonitrile

> <FORMULA>
C20H27NO11; C20H27NO11

> <MASS>
457.429

> <MONOISOTOPIC_MASS>
457.15841

> <CHARGE>
0

> <SMILES>
C(#N)[C@H](O[C@H]1[C@H](O)[C@@H](O)[C@H](O)[C@H](O1)CO[C@]2([C@H](O)[C@@H](O)[C@H](O)[C@H](O2)CO)[H])C3=CC=CC=C3

> <INCHI>
InChI=1S/C20H27NO11/c21-6-10(9-4-2-1-3-5-9)30-20-18(28)16(26)14(24)12(32-20)8-29-19-17(27)15(25)13(23)11(7-22)31-19/h1-5,10-20,22-28H,7-8H2/t10-,11+,12+,13+,14+,15-,16-,17+,18+,19+,20+/m0/s1

> <INCHIKEY>
XUCIJNAGGSZNQT-JHSLDZJXSA-N

> <BEILSTEIN_REGISTRY_NUMBER>
66856

> <CAS_REGISTRY_NUMBER>
29883-15-6

> <REAXYS_REGISTRY_NUMBER>
66856

> <CHEMIDPLUS>
29883-15-6

> <KEGG_COMPOUND_ACCESSION>
C08325

> <KNAPSACK_ACCESSION>
C00001437

> <METACYC_ACCESSION>
CPD-1125

> <WIKIPEDIA_ACCESSION>
Amygdalin

> <PUBMED_CITATION>
10670815; 12232058; 12372866; 12428943; 12975776; 16652960; 16880611; 17359643; 20191348; 25050339; 25237385; 26431391; 26719286; 27119432; 7092570

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