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38953-70-7 | 1-(2,3,4,6-tetra-O-acetyl-β-D-glucopyranosyl)imidazole
CAS No: 38953-70-7 Catalog No: AG00CKO8 MDL No:MFCD26793496
Product Description
Catalog Number:
AG00CKO8
Chemical Name:
1-(2,3,4,6-tetra-O-acetyl-β-D-glucopyranosyl)imidazole
CAS Number:
38953-70-7
MDL Number:
MFCD26793496
IUPAC Name:
[(2R,3R,4S,5R,6R)-3,4,5-triacetyloxy-6-imidazol-1-yloxan-2-yl]methyl acetate
InChI:
InChI=1S/C17H22N2O9/c1-9(20)24-7-13-14(25-10(2)21)15(26-11(3)22)16(27-12(4)23)17(28-13)19-6-5-18-8-19/h5-6,8,13-17H,7H2,1-4H3/t13-,14-,15+,16-,17-/m1/s1
InChI Key:
WTICWOCDMOSFLJ-NQNKBUKLSA-N
Properties
Complexity:
611
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
5
Defined Bond Stereocenter Count:
0
Exact Mass:
398.133g/mol
Formal Charge:
0
Heavy Atom Count:
28
Hydrogen Bond Acceptor Count:
10
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
398.368g/mol
Monoisotopic Mass:
398.133g/mol
Rotatable Bond Count:
10
Topological Polar Surface Area:
132A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.4
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