Home Other Building Blocks Bromo 2,3,4-Tri-O-benzoyl-L-fucopyranose

Bromo 2,3,4-Tri-O-benzoyl-L-fucopyranose

CAS No.:
855662-12-3
Catalog Number:
AG004UGW
Molecular Formula:
C27H23BrO7
Molecular Weight:
539.3713
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Product Description
Catalog Number:
AG004UGW
Chemical Name:
Bromo 2,3,4-Tri-O-benzoyl-L-fucopyranose
CAS Number:
855662-12-3
Molecular Formula:
C27H23BrO7
Molecular Weight:
539.3713
MDL Number:
MFCD09750813
IUPAC Name:
[(2S,3R,4R,5S)-4,5-dibenzoyloxy-6-bromo-2-methyloxan-3-yl] benzoate
InChI:
InChI=1S/C27H23BrO7/c1-17-21(33-25(29)18-11-5-2-6-12-18)22(34-26(30)19-13-7-3-8-14-19)23(24(28)32-17)35-27(31)20-15-9-4-10-16-20/h2-17,21-24H,1H3/t17-,21+,22+,23-,24?/m0/s1
InChI Key:
ZNQXFYBHGDPZCZ-QTDWSHGNSA-N
SMILES:
C[C@@H]1OC(Br)[C@H]([C@H]([C@@H]1OC(=O)c1ccccc1)OC(=O)c1ccccc1)OC(=O)c1ccccc1
Properties
Complexity:
725  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
4  
Defined Bond Stereocenter Count:
0
Exact Mass:
538.063g/mol
Formal Charge:
0
Heavy Atom Count:
35  
Hydrogen Bond Acceptor Count:
7  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
539.378g/mol
Monoisotopic Mass:
538.063g/mol
Rotatable Bond Count:
9  
Topological Polar Surface Area:
88.1A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
6.1  
Literature
Title Journal
Synthesis of GDP-5-thiosugars and their use as glycosyl donor substrates for glycosyltransferases. The Journal of organic chemistry 20030808
Properties