Isoamygdalin

Molecular Formula: C₂₀H₂₇NO₁₁

InChI: InChI=1/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?,11u,12u,13-,14-,15?,16?,17?,18?,19-,20-/m1/s1

InChIKey: InChIKey=XUCIJNAGGSZNQT-KZJAGXELBC
SMILES: C1=CC=C(C=C1)C(C#N)OC2C(C(C(C(O2)COC3C(C(C(C(O3)CO)O)O)O)O)O)O

Names:
    Benzeneacetonitrile, alpha-((6-O-beta-D-glucopyranosyl-beta-D-glucopyranosyl)oxy)- (9CI)
    D,L-Amygdalin
    D,L-Mandelonitrile beta-D-glucosido-6-beta-glucoside
    D,L-MANDELONITRILE, beta-D-GENTIOBIOSIDE
    Isoamygdalin
    NSC 251222
    2-phenyl-2-[(2S,5S)-3,4,5-trihydroxy-6-[[(2R,5S)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxymethyl]oxan-2-yl]oxy-acetonitrile
    51371-34-7

Registries:
    PubChem CID 39999
    PubChem ID 180949