Home Other Building Blocks Neu5Ac alpha(2-6)Gal beta(1-4)GlcNAc-beta-pNP

Neu5Ac alpha(2-6)Gal beta(1-4)GlcNAc-beta-pNP

CAS No.:
501427-93-6
Catalog Number:
AG00DD0S
Molecular Formula:
Molecular Weight:
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Product Description
Catalog Number:
AG00DD0S
Chemical Name:
Neu5Ac alpha(2-6)Gal beta(1-4)GlcNAc-beta-pNP
CAS Number:
501427-93-6
MDL Number:
MFCD15072185
IUPAC Name:
(2R,4S,5R,6R)-5-acetamido-2-[[(2R,3R,4S,5R,6S)-6-[(2R,3S,4R,5R,6S)-5-acetamido-4-hydroxy-2-(hydroxymethyl)-6-(4-nitrophenoxy)oxan-3-yl]oxy-3,4,5-trihydroxyoxan-2-yl]methoxy]-4-hydroxy-6-[(1R,2R)-1,2,3-trihydroxypropyl]oxane-2-carboxylic acid
InChI:
InChI=1S/C31H45N3O21/c1-11(37)32-19-15(39)7-31(30(46)47,55-27(19)21(41)16(40)8-35)50-10-18-22(42)24(44)25(45)29(53-18)54-26-17(9-36)52-28(20(23(26)43)33-12(2)38)51-14-5-3-13(4-6-14)34(48)49/h3-6,15-29,35-36,39-45H,7-10H2,1-2H3,(H,32,37)(H,33,38)(H,46,47)/t15-,16+,17+,18+,19+,20+,21+,22-,23+,24-,25+,26+,27+,28+,29-,31+/m0/s1
InChI Key:
TVDCKIMQUNLKLE-KOLSOZNPSA-N
Properties
Complexity:
1320  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
16  
Defined Bond Stereocenter Count:
0
Exact Mass:
795.255g/mol
Formal Charge:
0
Heavy Atom Count:
55  
Hydrogen Bond Acceptor Count:
21  
Hydrogen Bond Donor Count:
12  
Isotope Atom Count:
0
Molecular Weight:
795.701g/mol
Monoisotopic Mass:
795.255g/mol
Rotatable Bond Count:
14  
Topological Polar Surface Area:
379A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-5.6  
Properties