Di-(N-acetylneuramin)lactose

5-acetamido-6-[2-[5-acetamido-2-carboxy-4-hydroxy-6-(1,2,3-trihydroxypropyl)oxan-2-yl]oxy-1,3-dihydroxypropyl]-2-[3,5-dihydroxy-2-(hydroxymethyl)-6-[4,5,6-trihydroxy-2-(hydroxymethyl)oxan-3-yl]oxyoxan-4-yl]oxy-4-hydroxyoxane-2-carboxylic acid

Also Known As: Disialyllactose|Di-(N-acetylneuramin)lactose|GlyTouCan:G89984NP|G89984NP|Disialyllactose sodium salt from bovine colostrum|5-acetamido-6-[2-[5-acetamido-2-carboxy-4-hydroxy-6-(1,2,3-trihydroxypropyl)oxan-2-yl]oxy-1,3-dihydroxypropyl]-2-[3,5-dihydroxy-2-(hydroxymethyl)-6-[4,5,6-trihydroxy-2-(hydroxymethyl)oxan-3-yl]oxyoxan-4-yl]oxy-4-hydroxyoxane-2-carboxylic acid|Disialyllactose sodium salt from bovine colostrum, ~75% (HPAE/PAD)||A-Neu5Ac-(2 inverted exclamation marku8)-|A-Neu5Ac-(2 inverted exclamation marku3)-|A-D-Gal-(1 inverted exclamation marku4)-D-Glc|5-Acetamido-3,5-dideoxynon-2-ulopyranonosyl-(2->8)-5-acetamido-3,5-dideoxynon-2-ulopyranonosyl-(2->3)hexopyranosyl-(1->4)hexopyranose|5-acetamido-6-[2-[5-acetamido-2-carboxy-4-hydroxy-6-(1,2,3-trihydroxypropyl)tetrahydropyran-2-yl]oxy-1,3-dihydroxy-propyl]-2-[3,5-dihydroxy-2-(hydroxymethyl)-6-[4,5,6-trihydroxy-2-(hydroxymethyl)tetrahydropyran-3-yl]oxy-tetrahydropyran-4-yl]oxy-4-hydroxy-tetrahydropyran-2-carboxylic acid

Molecular Formula	C34H56N2O27
Molecular Weight	924.30707 g/mol
LogP	-11.0496
Topological Polar Surface Area	480.63 Ų
Hydrogen Bond Donors	18
Hydrogen Bond Acceptors	25
Rotatable Bonds	18
Exact Mass	924.30707
Monoisotopic Mass	924.30707
Heavy Atoms	63
Complexity	1563.5732

Chemical Identifiers

CAS Number	18409-15-9
SMILES	CC(=O)NC1C(CC(OC1C(C(CO)OC2(CC(C(C(O2)C(C(CO)O)O)NC(=O)C)O)C(=O)O)O)(C(=O)O)OC3C(C(OC(C3O)OC4C(OC(C(C4O)O)O)CO)CO)O)O