Home Aminos β-D-Glucopyranoside, 4-aminophenyl 4-O-β-D-galactopyranosyl-

β-D-Glucopyranoside, 4-aminophenyl 4-O-β-D-galactopyranosyl-

CAS No.:
17691-02-0
Catalog Number:
AG0024ZW
Molecular Formula:
C18H27NO11
Molecular Weight:
433.4071
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Product Description
Catalog Number:
AG0024ZW
Chemical Name:
β-D-Glucopyranoside, 4-aminophenyl 4-O-β-D-galactopyranosyl-
CAS Number:
17691-02-0
Molecular Formula:
C18H27NO11
Molecular Weight:
433.4071
MDL Number:
MFCD00077176
IUPAC Name:
(2S,3R,4S,5R,6R)-2-[(2R,3S,4R,5R,6S)-6-(4-aminophenoxy)-4,5-dihydroxy-2-(hydroxymethyl)oxan-3-yl]oxy-6-(hydroxymethyl)oxane-3,4,5-triol
InChI:
InChI=1S/C18H27NO11/c19-7-1-3-8(4-2-7)27-17-15(26)13(24)16(10(6-21)29-17)30-18-14(25)12(23)11(22)9(5-20)28-18/h1-4,9-18,20-26H,5-6,19H2/t9-,10-,11+,12+,13-,14-,15-,16-,17-,18+/m1/s1
InChI Key:
OCHWUNNDLIWPAO-MUKCROHVSA-N
SMILES:
OC[C@H]1O[C@@H](Oc2ccc(cc2)N)[C@@H]([C@H]([C@@H]1O[C@@H]1O[C@H](CO)[C@@H]([C@@H]([C@H]1O)O)O)O)O
Properties
Complexity:
534  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
10  
Defined Bond Stereocenter Count:
0
Exact Mass:
433.158g/mol
Formal Charge:
0
Heavy Atom Count:
30  
Hydrogen Bond Acceptor Count:
12  
Hydrogen Bond Donor Count:
8  
Isotope Atom Count:
0
Molecular Weight:
433.41g/mol
Monoisotopic Mass:
433.158g/mol
Rotatable Bond Count:
6  
Topological Polar Surface Area:
205A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-3.2  
Literature
Title Journal
Kinetic characterization of glycosidase activity from disaccharide conjugate to monosaccharide conjugate in Caco-2 cells. The Journal of pharmacy and pharmacology 20050501
Efficient synthesis of glyceroyl beta-lactoside and its derivatives through a condensation reaction by cellulase. Biochimica et biophysica acta 20030317
Properties