Hexadecyl 2-acetamido-2-deoxy-b-D-glucopyranoside

Catalog	DGS115414498
CAS	115414-49-8
Structure
Synonyms	β-D-Glucopyranoside, hexadecyl 2-(acetylamino)-2-deoxy-
IUPAC Name	N-[(2R,3R,4R,5S,6R)-2-hexadecoxy-4,5-dihydroxy-6-(hydroxymethyl)oxan-3-yl]acetamide
Molecular Weight	445.63
Molecular Formula	C24H47NO6
InChI	InChI=1S/C24H47NO6/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-30-24-21(25-19(2)27)23(29)22(28)20(18-26)31-24/h20-24,26,28-29H,3-18H2,1-2H3,(H,25,27)/t20-,21-,22-,23-,24-/m1/s1
InChI Key	WKLPLHUPPYUENY-MRKXFKPJSA-N
Purity	≥95%
Complexity	450
Exact Mass	445.34033822
Formal Charge	0
Heavy Atom Count	31
Hydrogen Bond Acceptor Count	6
Hydrogen Bond Donor Count	4
Isomeric SMILES	CCCCCCCCCCCCCCCCO[C@H]1[C@@H]([C@H]([C@@H]([C@H](O1)CO)O)O)NC(=O)C
MDL Number	MFCD08703744
Monoisotopic Mass	445.34033822
Rotatable Bond Count	18
Topological Polar Surface Area	108 Ų
XLogP3-AA	5.7