2,6-Dimethyl-4-heptyl-b-D-maltopyranoside

Catalog	DGS869638313
CAS	869638-31-3
Structure
Synonyms	2,6-Dimethylhept-4-yl 4-O-a-D-glucopyranosyl-b-D-glucopyranoside
IUPAC Name	(2R,3R,4S,5S,6R)-2-[(2R,3S,4R,5R,6R)-6-(2,6-dimethylheptan-4-yloxy)-4,5-dihydroxy-2-(hydroxymethyl)oxan-3-yl]oxy-6-(hydroxymethyl)oxane-3,4,5-triol
Molecular Weight	468.54
Molecular Formula	C21H40O11
InChI	InChI=1S/C21H40O11/c1-9(2)5-11(6-10(3)4)29-20-18(28)16(26)19(13(8-23)31-20)32-21-17(27)15(25)14(24)12(7-22)30-21/h9-28H,5-8H2,1-4H3/t12-,13-,14-,15+,16-,17-,18-,19-,20-,21-/m1/s1
InChI Key	RCXNRCWFTSDLDY-ZESVGKPKSA-N
Purity	≥99%
Solubility	≥20% (in water at 0-5 °C)
Appearance	White powder
Complexity	538
Conductance	<40 μS (10% solution in water)
Critical Micelle Concentration	(H2O) ~ 27.5 mM (1.2%)
Exact Mass	468.25706209
Formal Charge	0
Heavy Atom Count	32
Hydrogen Bond Acceptor Count	11
Hydrogen Bond Donor Count	7
Isomeric SMILES	CC(C)CC(CC(C)C)O[C@H]1[C@@H]([C@H]([C@@H]([C@H](O1)CO)O[C@@H]2[C@@H]([C@H]([C@@H]([C@H](O2)CO)O)O)O)O)O
MDL Number	MFCD09750643
Monoisotopic Mass	468.25706209
pH	5-8 (1% solution in water)
Rotatable Bond Count	10
Topological Polar Surface Area	179 Ų
XLogP3-AA	-0.8