Description
Ehretioside B isolated from the herbs of Diploclisia glaucescens.
Synonyms
[2-(β-D-Glucopyranosyloxy)-4-hydroxyphenyl]acetonitrile
IUPAC Name
2-[4-hydroxy-2-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyphenyl]acetonitrile
Molecular Formula
C14H17NO7
Canonical SMILES
C1=CC(=C(C=C1O)OC2C(C(C(C(O2)CO)O)O)O)CC#N
InChI
InChI=1S/C14H17NO7/c15-4-3-7-1-2-8(17)5-9(7)21-14-13(20)12(19)11(18)10(6-16)22-14/h1-2,5,10-14,16-20H,3,6H2/t10-,11-,12+,13-,14-/m1/s1
InChIKey
HVSMXONXCJBJIF-RKQHYHRCSA-N