Home Other Building Blocks ALPHA-NEU5AC-[2->8]-ALPHA-NEU5AC-[2->3]-BETA-D-GAL-[1->4]-D-GLC SODIUM SALT

ALPHA-NEU5AC-[2->8]-ALPHA-NEU5AC-[2->3]-BETA-D-GAL-[1->4]-D-GLC SODIUM SALT

CAS No.:
18409-15-9
Catalog Number:
AG00AU25
Molecular Formula:
Molecular Weight:
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Product Description
Catalog Number:
AG00AU25
Chemical Name:
ALPHA-NEU5AC-[2->8]-ALPHA-NEU5AC-[2->3]-BETA-D-GAL-[1->4]-D-GLC SODIUM SALT
CAS Number:
18409-15-9
MDL Number:
MFCD00133272
IUPAC Name:
5-acetamido-6-[2-[5-acetamido-2-carboxy-4-hydroxy-6-(1,2,3-trihydroxypropyl)oxan-2-yl]oxy-1,3-dihydroxypropyl]-2-[3,5-dihydroxy-2-(hydroxymethyl)-6-[4,5,6-trihydroxy-2-(hydroxymethyl)oxan-3-yl]oxyoxan-4-yl]oxy-4-hydroxyoxane-2-carboxylic acid
InChI:
InChI=1S/C34H56N2O27/c1-9(41)35-17-11(43)3-33(31(53)54,61-26(17)19(46)13(45)5-37)60-15(7-39)21(48)27-18(36-10(2)42)12(44)4-34(62-27,32(55)56)63-28-20(47)14(6-38)58-30(24(28)51)59-25-16(8-40)57-29(52)23(50)22(25)49/h11-30,37-40,43-52H,3-8H2,1-2H3,(H,35,41)(H,36,42)(H,53,54)(H,55,56)
InChI Key:
IESOVNOGVZBLMG-UHFFFAOYSA-N
Properties
Complexity:
1570  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
924.307g/mol
Formal Charge:
0
Heavy Atom Count:
63  
Hydrogen Bond Acceptor Count:
27  
Hydrogen Bond Donor Count:
18  
Isotope Atom Count:
0
Molecular Weight:
924.809g/mol
Monoisotopic Mass:
924.307g/mol
Rotatable Bond Count:
18  
Topological Polar Surface Area:
481A^2
Undefined Atom Stereocenter Count:
22  
Undefined Bond Stereocenter Count:
0
XLogP3:
-9.7  
Literature
Title Journal
Efficient synthesis of 6'-sialyllactose, 6,6'-disialyllactose, and 6'-KDO-lactose by metabolically engineered E. coli expressing a multifunctional sialyltransferase from the Photobacterium sp. JT-ISH-224. Carbohydrate research 20100702
Sequencing and characterization of oligosaccharides using infrared multiphoton dissociation and boronic acid derivatization in a quadrupole ion trap. Journal of the American Society for Mass Spectrometry 20071201
Lactones of disialyl lactose: characterisation by NMR and mass spectra. Carbohydrate research 20060501
Common binding site for disialyllactose and tri-peptide in C-fragment of tetanus neurotoxin. Proteins 20051101
Properties