N-Acetyl-1-O-octyl-3-O-[3-O-[(N-acetyl-2-deoxy-alpha-neuraminic acid sodium)-2-yl]-beta-D-galactopyranosyl]-6-O-[2-(acetylamino)-4-O-[3-O-[(N-acetyl-2-deoxy-alpha-neuraminic acid sodium)-2-yl]-beta-D-galactopyranosyl]-2-deoxy-beta-D-glucopyranosyl]-alpha-D-galactosamine salt

Compound Identifiers & Properties

PubChem CID

101255213

SMILES

CCCCCCCCO[C@H]1[C@H]([C@H](C([C@H](O1)CO[C@@H]2[C@@H]([C@H]([C@H]([C@@H](O2)CO)O[C@@H]3[C@@H]([C@H]([C@@H]([C@@H](O3)CO)O)O[C@@]4(C[C@@H]([C@H]([C@H](O4)[C@H]([C@H](CO)O)O)N=C(C)[O-])O)C(=O)O)O)O)NC(=O)C)O)O[C@@H]5[C@@H]([C@H]([C@@H]([C@@H](O5)CO)O)O[C@@]6(C[C@@H]([C@H]([C@H](O6)[C@H]([C@H](CO)O)O)N=C(C)[O-])O)C(=O)O)O)NC(=O)C.[Na+].[Na+]

Canonical SMILES

CCCCCCCCO[C@@H]1O[C@H](CO[C@H]2O[C@@H](CO)[C@H](O[C@H]3O[C@@H](CO)[C@@H](O)[C@H](O[C@]4(C(=O)O)C[C@H](O)[C@@H](N=C(C)[O-])[C@@H]([C@@H](O)[C@@H](O)CO)O4)[C@H]3O)[C@H](O)[C@H]2NC(C)=O)C(O)[C@H](O[C@H]2O[C@@H](CO)[C@@H](O)[C@H](O[C@]3(C(=O)O)C[C@H](O)[C@@H](N=C(C)[O-])[C@@H]([C@@H](O)[C@@H](O)CO)O3)[C@H]2O)[C@@H]1NC(C)=O.[Na+].[Na+]