Analyte Name

Methyl 2-(Acetylamino)-2-deoxy-4,6-O-(phenylmethylene)-alpha-D-glucopyranoside 3-(S-Methyl Carbonodithioate)

CAS Number

100638-83-3

Molecular Formula

C18 H23 N O6 S2

Molecular Weight

413.508

Accurate Mass

413.097

SMILES

COC1O[C@@H]2CO[C@H](O[C@H]2[C@@H](OC(=S)SC)[C@H]1NC(=O)C)c3ccccc3

InChI

InChI=1S/C18H23NO6S2/c1-10(20)19-13-15(25-18(26)27-3)14-12(23-17(13)21-2)9-22-16(24-14)11-7-5-4-6-8-11/h4-8,12-17H,9H2,1-3H3,(H,19,20)/t12-,13-,14-,15+,16-,17?/m1/s1

IUPAC

O-[(2R,4aR,7R,8S,8aS)-7-acetamido-6-methoxy-2-phenyl-4,4a,6,7,8,8a-hexahydropyrano[3,2-d][1,3]dioxin-8-yl] methylsulfanylmethanethioate

Shipping Temperature

Room Temperature

Country of Origin

CANADA

Product Format

Neat