Hexadecyl b-D-glucopyranoside

Catalog	DGS75319630
CAS	75319-63-0
Structure
Synonyms	Hexadecyl glucoside
IUPAC Name	(2R,3R,4S,5S,6R)-2-hexadecoxy-6-(hydroxymethyl)oxane-3,4,5-triol
Molecular Weight	404.58
Molecular Formula	C22H44O6
InChI	InChI=1S/C22H44O6/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-27-22-21(26)20(25)19(24)18(17-23)28-22/h18-26H,2-17H2,1H3/t18-,19-,20+,21-,22-/m1/s1
InChI Key	PAEMERHSTIDLSE-QMCAAQAGSA-N
Appearance	White to off-white powder
Complexity	354
Exact Mass	404.31378912
Formal Charge	0
Heavy Atom Count	28
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)O
MDL Number	MFCD15144893
Monoisotopic Mass	404.31378912
Rotatable Bond Count	17
Topological Polar Surface Area	99.4 Ų
XLogP3-AA	5.7