Home Other Building Blocks Neu5Ac2-β-3Gal1-β-4GlcNAc

Neu5Ac2-β-3Gal1-β-4GlcNAc

CAS No.:
210418-18-1
Catalog Number:
AG00C2Y1
Molecular Formula:
Molecular Weight:
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Product Description
Catalog Number:
AG00C2Y1
Chemical Name:
Neu5Ac2-β-3Gal1-β-4GlcNAc
CAS Number:
210418-18-1
MDL Number:
MFCD00797625
IUPAC Name:
(2R,4S,6R)-5-acetamido-2-[(2S,3R,4S,5S,6R)-2-[(2R,3S,4R,5R)-5-acetamido-4,6-dihydroxy-2-(hydroxymethyl)oxan-3-yl]oxy-3,5-dihydroxy-6-(hydroxymethyl)oxan-4-yl]oxy-4-hydroxy-6-[(1R,2R)-1,2,3-trihydroxypropyl]oxane-2-carboxylic acid
InChI:
InChI=1S/C25H42N2O19/c1-7(31)26-13-9(33)3-25(24(40)41,45-20(13)15(35)10(34)4-28)46-21-16(36)11(5-29)43-23(18(21)38)44-19-12(6-30)42-22(39)14(17(19)37)27-8(2)32/h9-23,28-30,33-39H,3-6H2,1-2H3,(H,26,31)(H,27,32)(H,40,41)/t9-,10+,11+,12+,13?,14+,15+,16-,17+,18+,19+,20+,21-,22?,23-,25+/m0/s1
InChI Key:
GVXWGQLSDZJHFY-RMKBUKBJSA-N
Properties
Complexity:
1050  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
14  
Defined Bond Stereocenter Count:
0
Exact Mass:
674.238g/mol
Formal Charge:
0
Heavy Atom Count:
46  
Hydrogen Bond Acceptor Count:
19  
Hydrogen Bond Donor Count:
13  
Isotope Atom Count:
0
Molecular Weight:
674.606g/mol
Monoisotopic Mass:
674.238g/mol
Rotatable Bond Count:
12  
Topological Polar Surface Area:
344A^2
Undefined Atom Stereocenter Count:
2  
Undefined Bond Stereocenter Count:
0
XLogP3:
-7.2  
Properties