4-Deoxy-D-chitobiose Heptaacetate

Analyte Name

4-Deoxy-D-chitobiose Heptaacetate

CAS Number

1228931-51-8

Molecular Formula

C26 H38 N2 O15

Molecular Weight

618.584

Accurate Mass

618.227

SMILES

CC(=O)N[C@@H]1[C@H](C[C@@H](COC(=O)C)O[C@H]1O[C@@H]2[C@@H](COC(=O)C)OC(OC(=O)C)[C@H](NC(=O)C)[C@H]2OC(=O)C)OC(=O)C

InChI

InChI=1S/C26H38N2O15/c1-11(29)27-21-19(38-15(5)33)8-18(9-36-13(3)31)41-25(21)43-23-20(10-37-14(4)32)42-26(40-17(7)35)22(28-12(2)30)24(23)39-16(6)34/h18-26H,8-10H2,1-7H3,(H,27,29)(H,28,30)/t18-,19-,20+,21+,22+,23+,24+,25-,26?/m0/s1

IUPAC

[(2S,4S,5R,6S)-5-acetamido-6-[(2R,3S,4R,5R)-5-acetamido-4,6-diacetyloxy-2-(acetyloxymethyl)oxan-3-yl]oxy-4-acetyloxyoxan-2-yl]methyl acetate

Shipping Temperature

Room Temperature

Country of Origin

CANADA

Product Format

Neat