Home Other Building Blocks 4-O-(α-D-Glucopyranosyl)-D-gluco-hexonic acid

4-O-(α-D-Glucopyranosyl)-D-gluco-hexonic acid

CAS No.:
534-42-9
Catalog Number:
AG00DJJT
Molecular Formula:
Molecular Weight:
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Product Description
Catalog Number:
AG00DJJT
Chemical Name:
4-O-(α-D-Glucopyranosyl)-D-gluco-hexonic acid
CAS Number:
534-42-9
MDL Number:
MFCD30738187
IUPAC Name:
(2R,3R,4R,5R)-2,3,5,6-tetrahydroxy-4-[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyhexanoic acid
InChI:
InChI=1S/C12H22O12/c13-1-3(15)10(7(18)8(19)11(21)22)24-12-9(20)6(17)5(16)4(2-14)23-12/h3-10,12-20H,1-2H2,(H,21,22)/t3-,4-,5-,6+,7-,8-,9-,10-,12-/m1/s1
InChI Key:
JYTUSYBCFIZPBE-QOKIMYEXSA-N
UNII:
47RDD4XT2O
Properties
Complexity:
406  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
9  
Defined Bond Stereocenter Count:
0
Exact Mass:
358.111g/mol
Formal Charge:
0
Heavy Atom Count:
24  
Hydrogen Bond Acceptor Count:
12  
Hydrogen Bond Donor Count:
9  
Isotope Atom Count:
0
Molecular Weight:
358.296g/mol
Monoisotopic Mass:
358.111g/mol
Rotatable Bond Count:
8  
Topological Polar Surface Area:
218A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-5  
Literature
Title Journal
Discovery of cellobionic acid phosphorylase in cellulolytic bacteria and fungi. FEBS letters 20131101
Production of oligosaccharides and cellobionic acid by Fibrobacter succinogenes S85 growing on sugars, cellulose and wheat straw. Applied microbiology and biotechnology 20090601
Properties