Home Other Building Blocks 2-ACETAMIDO-2-DEOXY-1,3,4,6-TETRA-O-ACETYL-ALPHA-D-GLUCOPYRANOSE

2-ACETAMIDO-2-DEOXY-1,3,4,6-TETRA-O-ACETYL-ALPHA-D-GLUCOPYRANOSE

CAS No.:
7784-54-5
Catalog Number:
AG00G2QJ
Molecular Formula:
C16H23NO10
Molecular Weight:
389.3545
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Product Description
Catalog Number:
AG00G2QJ
Chemical Name:
2-ACETAMIDO-2-DEOXY-1,3,4,6-TETRA-O-ACETYL-ALPHA-D-GLUCOPYRANOSE
CAS Number:
7784-54-5
Molecular Formula:
C16H23NO10
Molecular Weight:
389.3545
MDL Number:
MFCD00065051
IUPAC Name:
[(2R,3S,4R,5R,6R)-5-acetamido-3,4,6-triacetyloxyoxan-2-yl]methyl acetate
InChI:
InChI=1S/C16H23NO10/c1-7(18)17-13-15(25-10(4)21)14(24-9(3)20)12(6-23-8(2)19)27-16(13)26-11(5)22/h12-16H,6H2,1-5H3,(H,17,18)/t12-,13-,14-,15-,16+/m1/s1
InChI Key:
OVPIZHVSWNOZMN-QCODTGAPSA-N
SMILES:
CC(=O)OC[C@H]1O[C@H](OC(=O)C)[C@@H]([C@H]([C@@H]1OC(=O)C)OC(=O)C)NC(=O)C
EC Number:
232-071-0
Properties
Complexity:
604  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
5  
Defined Bond Stereocenter Count:
0
Exact Mass:
389.132g/mol
Formal Charge:
0
Heavy Atom Count:
27  
Hydrogen Bond Acceptor Count:
10  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
389.357g/mol
Monoisotopic Mass:
389.132g/mol
Rotatable Bond Count:
10  
Topological Polar Surface Area:
144A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.1  
Literature
Title Journal
Hijacking a biosynthetic pathway yields a glycosyltransferase inhibitor within cells. Nature chemical biology 20110301
Properties