Home Other Building Blocks 2-O-(p-Nitrophenyl)-α-D-N-glycolylneuraminic Acid

2-O-(p-Nitrophenyl)-α-D-N-glycolylneuraminic Acid

CAS No.:
1000890-36-7
Catalog Number:
AG008W7Y
Molecular Formula:
Molecular Weight:
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Product Description
Catalog Number:
AG008W7Y
Chemical Name:
2-O-(p-Nitrophenyl)-α-D-N-glycolylneuraminic Acid
CAS Number:
1000890-36-7
MDL Number:
MFCD04039648
IUPAC Name:
(2S,4S,5R,6R)-4-hydroxy-5-[(2-hydroxyacetyl)amino]-2-(4-nitrophenoxy)-6-[(1R,2R)-1,2,3-trihydroxypropyl]oxane-2-carboxylic acid
InChI:
InChI=1S/C17H22N2O12/c20-6-11(23)14(25)15-13(18-12(24)7-21)10(22)5-17(31-15,16(26)27)30-9-3-1-8(2-4-9)19(28)29/h1-4,10-11,13-15,20-23,25H,5-7H2,(H,18,24)(H,26,27)/t10-,11+,13+,14+,15+,17+/m0/s1
InChI Key:
XZIZFIVNPXSZFF-ZLVOJWICSA-N
Properties
Complexity:
650  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
6  
Defined Bond Stereocenter Count:
0
Exact Mass:
446.117g/mol
Formal Charge:
0
Heavy Atom Count:
31  
Hydrogen Bond Acceptor Count:
12  
Hydrogen Bond Donor Count:
7  
Isotope Atom Count:
0
Molecular Weight:
446.365g/mol
Monoisotopic Mass:
446.117g/mol
Rotatable Bond Count:
8  
Topological Polar Surface Area:
232A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-1.9  
Properties