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132776-25-1 | Uridine, 3'-azido-2',3'-dideoxy-2'-fluoro-5-methyl-5'-O-(triphenylmethyl)- (9CI)
CAS No: 132776-25-1 Catalog No: AG00114W MDL No:
Product Description
Catalog Number:
AG00114W
Chemical Name:
Uridine, 3'-azido-2',3'-dideoxy-2'-fluoro-5-methyl-5'-O-(triphenylmethyl)- (9CI)
CAS Number:
132776-25-1
Molecular Formula:
C29H26FN5O4
Molecular Weight:
527.5462
IUPAC Name:
1-[(2R,3R,4R,5S)-4-azido-3-fluoro-5-(trityloxymethyl)oxolan-2-yl]-5-methylpyrimidine-2,4-dione
InChI:
InChI=1S/C29H26FN5O4/c1-19-17-35(28(37)32-26(19)36)27-24(30)25(33-34-31)23(39-27)18-38-29(20-11-5-2-6-12-20,21-13-7-3-8-14-21)22-15-9-4-10-16-22/h2-17,23-25,27H,18H2,1H3,(H,32,36,37)/t23-,24-,25-,27-/m1/s1
InChI Key:
ROMMFHSLNJIJCT-DLGLWYJGSA-N
SMILES:
[N-]=[N+]=N[C@@H]1[C@@H](COC(c2ccccc2)(c2ccccc2)c2ccccc2)O[C@H]([C@@H]1F)n1cc(C)c(=O)[nH]c1=O
Properties
Complexity:
921
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
4
Defined Bond Stereocenter Count:
0
Exact Mass:
527.197g/mol
Formal Charge:
0
Heavy Atom Count:
39
Hydrogen Bond Acceptor Count:
7
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
527.556g/mol
Monoisotopic Mass:
527.197g/mol
Rotatable Bond Count:
8
Topological Polar Surface Area:
82.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
5.3
Literature
| Title | Journal |
|---|---|
| Fluorinated sugar analogues of potential anti-HIV-1 nucleosides. | Journal of medicinal chemistry 19910501 |
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