orb1702116

N-[1-[5-[4,5-bis[[3-acetamido-4,5-dihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy]-3-hydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-3,4-dihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-3-hydroxyoctadec-4-en-2-yl]tetracosanamide

Also Known As: Tetracosanamide, N-[1-[[[O-2-(acetylamino)-2-deoxy-I(2)-D-galactopyranosyl-(1a4)-O-[2-(acetylamino)-2-deoxy-I(2)-D-glucopyranosyl-(1a3)]-O-I(2)-D-galactopyranosyl-(1a4)-I(2)-D-glucopyranosyl]oxy]methyl]-2-hydroxy-3-heptadecenyl]-, [R-[R*,S*-(E)]]-

Molecular Formula	C70H129N3O23
Molecular Weight	1379.9017 g/mol
LogP	9.7
Topological Polar Surface Area	404.0 Ų
Hydrogen Bond Donors	15
Hydrogen Bond Acceptors	23
Rotatable Bonds	52
Exact Mass	1379.9017
Monoisotopic Mass	1379.9017
Heavy Atoms	96
Complexity	2060.0

Chemical Identifiers

CAS Number	107221-01-2
SMILES	CCCCCCCCCCCCCCCCCCCCCCCC(=O)NC(COC1C(C(C(C(O1)CO)OC2C(C(C(C(O2)CO)OC3C(C(C(C(O3)CO)O)O)NC(=O)C)OC4C(C(C(C(O4)CO)O)O)NC(=O)C)O)O)O)C(C=CCCCCCCCCCCCCC)O
InChIKey	YAVBLHXWKRSXJS-UHFFFAOYSA-N