beta-D-Galactopyranosyl-(1->4)-2-acetamido-2-deoxy-beta-D-galactopyranosyl-(1->6)-[beta-D-galactopyranosyl-(1->3)-2-acetamido-2-deoxy-beta-D-glucopyranosyl-(1->3)]-alpha-L-altropyranosyl-(1->4)-D-glucose
[CAS# 210647-98-6]

Identification

• Name: beta-D-Galactopyranosyl-(1->4)-2-acetamido-2-deoxy-beta-D-galactopyranosyl-(1->6)-[beta-D-galactopyranosyl-(1->3)-2-acetamido-2-deoxy-beta-D-glucopyranosyl-(1->3)]-alpha-L-altropyranosyl-(1->4)-D-glucose
• Molecular Formula: C₄₀H₆₈N₂O₃₁
• Molecular Weight: 1072.96
• CAS Registry Number: 210647-98-6
• SMILES: CC(=O)N[C@@H]5[C@@H](O)C(O[C@@H]1O[C@H](CO)[C@H](O)[C@H](O)[C@H]1O)[C@@H](CO)O[C@H]5OCC4O[C@@H](O[C@H]([C@H](O)CO)[C@H](O)[C@@H](O)C=O)[C@H](O)[C@@H](O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O[C@@H]2O[C@H](CO)[C@H](O)[C@H](O)[C@H]2O)[C@H]3NC(C)=O)[C@H]4O
• InChI: 1S/C40H68N2O31/c1-10(49)41-19-26(58)33(71-38-29(61)27(59)22(54)14(5-45)66-38)17(8-48)68-36(19)64-9-18-25(57)35(31(63)40(69-18)70-32(13(52)4-44)21(53)12(51)3-43)73-37-20(42-11(2)50)34(24(56)16(7-47)65-37)72-39-30(62)28(60)23(55)15(6-46)67-39/h3,12-40,44-48,51-63H,4-9H2,1-2H3,(H,41,49)(H,42,50)/t12-,13+,14+,15+,16+,17+,18?,19+,20+,21+,22-,23-,24+,25-,26+,27-,28-,29+,30+,31+,32+,33?,34+,35-,36+,37-,38-,39-,40-/m0/s1
• InChIKey: ZDZMLVPSYYRJNI-CYQYEHMMSA-N

Properties

• Density: 1.742g/cm³ (Cal.)
• Boiling point: 1480.426°C at 760 mmHg (Cal.)
• Flash point: 849.131°C (Cal.)
• Refractive index: 1.667 (Cal.)