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130351-60-9 | Uridine, 2',3'-dideoxy-3'-(hydroxymethyl)-5-iodo- (9CI)
CAS No: 130351-60-9 Catalog No: AG000UB0 MDL No:
Product Description
Catalog Number:
AG000UB0
Chemical Name:
Uridine, 2',3'-dideoxy-3'-(hydroxymethyl)-5-iodo- (9CI)
CAS Number:
130351-60-9
Molecular Formula:
C10H13IN2O5
Molecular Weight:
368.1251
IUPAC Name:
1-[(2R,4R,5S)-4,5-bis(hydroxymethyl)oxolan-2-yl]-5-iodopyrimidine-2,4-dione
InChI:
InChI=1S/C10H13IN2O5/c11-6-2-13(10(17)12-9(6)16)8-1-5(3-14)7(4-15)18-8/h2,5,7-8,14-15H,1,3-4H2,(H,12,16,17)/t5-,7-,8-/m1/s1
InChI Key:
GESSWOYGKDTRJA-LPBLVHEISA-N
SMILES:
OC[C@H]1O[C@H](C[C@@H]1CO)n1cc(I)c(=O)[nH]c1=O
Properties
Complexity:
400
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
3
Defined Bond Stereocenter Count:
0
Exact Mass:
367.987g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
3
Isotope Atom Count:
0
Molecular Weight:
368.127g/mol
Monoisotopic Mass:
367.987g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
99.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-1.3
Literature
| Title | Journal |
|---|---|
| Synthesis and antiviral activity of 3'-deoxy-3'-C-hydroxymethyl nucleosides. | Journal of medicinal chemistry 19900901 |
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