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81256-87-3

81256-87-3 | 5'-O-DMT-2'-O-TBDMS-N-Bz-Cytidine

CAS No: 81256-87-3 Catalog No: AG005EYK MDL No:MFCD00080295

Product Description

Catalog Number:
AG005EYK
Chemical Name:
5'-O-DMT-2'-O-TBDMS-N-Bz-Cytidine
CAS Number:
81256-87-3
Molecular Formula:
C43H49N3O8Si
Molecular Weight:
763.9500
MDL Number:
MFCD00080295
IUPAC Name:
N-[1-[(2R,3R,4R,5R)-5-[[bis(4-methoxyphenyl)-phenylmethoxy]methyl]-3-[tert-butyl(dimethyl)silyl]oxy-4-hydroxyoxolan-2-yl]-2-oxopyrimidin-4-yl]benzamide
InChI:
InChI=1S/C43H49N3O8Si/c1-42(2,3)55(6,7)54-38-37(47)35(53-40(38)46-27-26-36(45-41(46)49)44-39(48)29-14-10-8-11-15-29)28-52-43(30-16-12-9-13-17-30,31-18-22-33(50-4)23-19-31)32-20-24-34(51-5)25-21-32/h8-27,35,37-38,40,47H,28H2,1-7H3,(H,44,45,48,49)/t35-,37-,38-,40-/m1/s1
InChI Key:
AOXWVTIMEGOVNF-PKGPUZNISA-N
SMILES:
COc1ccc(cc1)C(c1ccc(cc1)OC)(c1ccccc1)OC[C@H]1O[C@H]([C@@H]([C@@H]1O)O[Si](C(C)(C)C)(C)C)n1ccc(nc1=O)NC(=O)c1ccccc1

Properties

Complexity:
1320  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
4  
Defined Bond Stereocenter Count:
0
Exact Mass:
763.329g/mol
Formal Charge:
0
Heavy Atom Count:
55  
Hydrogen Bond Acceptor Count:
8  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
763.963g/mol
Monoisotopic Mass:
763.329g/mol
Rotatable Bond Count:
14  
Topological Polar Surface Area:
128A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0

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