6-Deoxy-alpha-L-Galactopyranosyl-(1->4)-[3-O-Sulfo-beta-D-Galactopyranosyl-(1->3)]-2-Acetamido-2-Deoxy-beta-D-Glucopyranose
[CAS# 153088-71-2]

Identification

• Name: 6-Deoxy-alpha-L-Galactopyranosyl-(1->4)-[3-O-Sulfo-beta-D-Galactopyranosyl-(1->3)]-2-Acetamido-2-Deoxy-beta-D-Glucopyranose
• Synonyms: [3OSO3]Galbeta1-3(Fucalpha1-4)GlcNAcbeta; 3'-Sulfated Lewis A; 6-deoxy-α-L-galactopyranosyl-(1-> 4)-[3-O-sulfo-β-D-galactopyranosyl-(1-> 3)]-2-acetamido-2-deoxy-β-D-glucopyranose
• Molecular Formula: C₂₀H₃₅NO₁₈S
• Molecular Weight: 609.55
• CAS Registry Number: 153088-71-2
• SMILES: O=S(=O)(O)O[C@@H]1[C@@H](O)[C@@H](O[C@H](CO)[C@@H]1O)O[C@H]3[C@H](O[C@@H]2O[C@H]([C@@H](O)[C@@H](O)[C@@H]2O)C)[C@H](O[C@@H](O)[C@@H]3NC(=O)C)CO
• InChI: 1S/C20H35NO18S/c1-5-10(25)12(27)13(28)19(34-5)37-15-8(4-23)35-18(30)9(21-6(2)24)16(15)38-20-14(29)17(39-40(31,32)33)11(26)7(3-22)36-20/h5,7-20,22-23,25-30H,3-4H2,1-2H3,(H,21,24)(H,31,32,33)/t5-,7+,8+,9+,10+,11-,12+,13-,14+,15+,16+,17-,18+,19-,20-/m0/s1
• InChIKey: ABZKLZZRLAPTDK-JGMUFZQJSA-N

Properties

• Density: 1.765g/cm³ (Cal.)
• Refractive index: 1.644 (Cal.)