Home Other Building Blocks 2-O-(O-NITROPHENYL)-ALPHA-D-N-ACETYLNEURAMINIC ACID

2-O-(O-NITROPHENYL)-ALPHA-D-N-ACETYLNEURAMINIC ACID

CAS No.:
157707-92-1
Catalog Number:
AG00APXI
Molecular Formula:
Molecular Weight:
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Product Description
Catalog Number:
AG00APXI
Chemical Name:
2-O-(O-NITROPHENYL)-ALPHA-D-N-ACETYLNEURAMINIC ACID
CAS Number:
157707-92-1
MDL Number:
MFCD00214337
IUPAC Name:
(2S,4S,5R,6R)-5-acetamido-4-hydroxy-2-(2-nitrophenoxy)-6-[(1R,2R)-1,2,3-trihydroxypropyl]oxane-2-carboxylic acid
InChI:
InChI=1S/C17H22N2O11/c1-8(21)18-13-10(22)6-17(16(25)26,30-15(13)14(24)11(23)7-20)29-12-5-3-2-4-9(12)19(27)28/h2-5,10-11,13-15,20,22-24H,6-7H2,1H3,(H,18,21)(H,25,26)/t10-,11+,13+,14+,15+,17+/m0/s1
InChI Key:
HWBGFIGDTJBVQD-ZLVOJWICSA-N
Properties
Complexity:
642  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
6  
Defined Bond Stereocenter Count:
0
Exact Mass:
430.122g/mol
Formal Charge:
0
Heavy Atom Count:
30  
Hydrogen Bond Acceptor Count:
11  
Hydrogen Bond Donor Count:
6  
Isotope Atom Count:
0
Molecular Weight:
430.366g/mol
Monoisotopic Mass:
430.122g/mol
Rotatable Bond Count:
7  
Topological Polar Surface Area:
212A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-1.3  
Properties