Analyte Name

O-beta-D-Galactopyranosyl-(1-4)-O-2-(acetylamino)-2-deoxy-beta-D-glucopyranosyl-(1-2)-O-alpha-D-mannopyranosyl-(1-3)-O-beta-D-mannopyranosyl-(1-4)-2-(acetylamino)-2-deoxy-beta-D-glucopyranose-d6

Molecular Formula

C34 H52 D6 N2 O26

Molecular Weight

916.86

Accurate Mass

916.37

SMILES

O[C@H]1[C@H](O)[C@@H](CO)O[C@H](O[C@H]2[C@H](O)[C@@H](CO)O[C@@H](O[C@H]3[C@H](O)[C@@H](NC(C([2H])([2H])[2H])=O)C(O)O[C@@H]3CO)[C@H]2O)[C@H]1O[C@H]4[C@H](NC(C([2H])([2H])[2H])=O)[C@@H](O)[C@H](O[C@H]5[C@H](O)[C@@H](O)[C@@H](O)[C@@H](CO)O5)[C@@H](CO)O4

InChI

InChI=1S/C34H58N2O26/c1-8(42)35-15-20(47)26(13(6-40)54-30(15)53)60-33-25(52)28(19(46)12(5-39)56-33)61-34-29(23(50)18(45)11(4-38)57-34)62-31-16(36-9(2)43)21(48)27(14(7-41)58-31)59-32-24(51)22(49)17(44)10(3-37)55-32/h10-34,37-41,44-53H,3-7H2,1-2H3,(H,35,42)(H,36,43)/t10-,11+,12-,13-,14-,15-,16-,17+,18+,19-,20-,21-,22+,23-,24-,25+,26-,27-,28+,29-,30?,31+,32+,33+,34+/m1/s1/i1D3,2D3

IUPAC

N-((2S,3R,4R,5S,6R)-2-(((2R,3S,4S,5S,6R)-2-(((2S,3S,4S,5R,6R)-2-(((2R,3S,4R,5R)-5-(acetamido-2,2,2-d3)-4,6-dihydroxy-2-(hydroxymethyl)tetrahydro-2H-pyran-3-yl)oxy)-3,5-dihydroxy-6-(hydroxymethyl)tetrahydro-2H-pyran-4-yl)oxy)-4,5-dihydroxy-6-(hydroxymethyl)tetrahydro-2H-pyran-3-yl)oxy)-4-hydroxy-6-(hydroxymethyl)-5-(((2S,3R,4S,5R,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydro-2H-pyran-2-yl)oxy)tetrahydro-2H-pyran-3-yl)acetamide-2,2,2-d3

SIL Type

Deuterium

Shipping Temperature

Room Temperature

Country of Origin

CANADA

Product Format

Neat