Home Other Building Blocks α-D-Galactopyranose, 1-thio-, 1,2,3,4,6-pentaacetate

α-D-Galactopyranose, 1-thio-, 1,2,3,4,6-pentaacetate

CAS No.:
130796-15-5
Catalog Number:
AG000UY8
Molecular Formula:
C16H32O15S
Molecular Weight:
496.4813
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Product Description
Catalog Number:
AG000UY8
Chemical Name:
α-D-Galactopyranose, 1-thio-, 1,2,3,4,6-pentaacetate
CAS Number:
130796-15-5
Molecular Formula:
C16H32O15S
Molecular Weight:
496.4813
MDL Number:
MFCD28347481
IUPAC Name:
[(2R,3S,4S,5S,6R)-3,4,5-triacetyloxy-6-acetylsulfanyloxan-2-yl]methyl acetate
InChI:
InChI=1S/C16H22O10S/c1-7(17)22-6-12-13(23-8(2)18)14(24-9(3)19)15(25-10(4)20)16(26-12)27-11(5)21/h12-16H,6H2,1-5H3/t12-,13+,14+,15+,16-/m1/s1
InChI Key:
CFAJEDWNNGFOQV-OLMNGRFOSA-N
SMILES:
CC(=O)O.CC(=O)O.CC(=O)O.CC(=O)O.CC(=O)O.OC[C@H]1O[C@H](S)[C@@H]([C@H]([C@H]1O)O)O
Properties
Complexity:
604  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
5  
Defined Bond Stereocenter Count:
0
Exact Mass:
406.093g/mol
Formal Charge:
0
Heavy Atom Count:
27  
Hydrogen Bond Acceptor Count:
11  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
406.402g/mol
Monoisotopic Mass:
406.093g/mol
Rotatable Bond Count:
11  
Topological Polar Surface Area:
157A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.2  
Properties