For research use only. Not for therapeutic Use.
Catalog Number | R013149 |
CAS Number | 99-19-4 |
Synonyms | (αS)-α-(β-D-Glucopyranosyloxy)benzeneacetonitrile; L-Prunasin; Sambunigrin; (2S)-Sambunigrin; |
Molecular Formula | C14H17NO6 |
Purity | ≥95% |
Storage | -20°C |
IUPAC Name | (2S)-2-phenyl-2-[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyacetonitrile |
InChI | InChI=1S/C14H17NO6/c15-6-9(8-4-2-1-3-5-8)20-14-13(19)12(18)11(17)10(7-16)21-14/h1-5,9-14,16-19H,7H2/t9-,10-,11-,12+,13-,14-/m1/s1 |
InChIKey | ZKSZEJFBGODIJW-YOVYLDAJSA-N |
SMILES | C1=CC=C(C=C1)C(C#N)OC2C(C(C(C(O2)CO)O)O)O |