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3052-06-0 | 2,4(1H,3H)-Pyrimidinedione, 1-β-D-arabinofuranosyl-5-iodo-
CAS No: 3052-06-0 Catalog No: AG0030F8 MDL No:
Product Description
Catalog Number:
AG0030F8
Chemical Name:
2,4(1H,3H)-Pyrimidinedione, 1-β-D-arabinofuranosyl-5-iodo-
CAS Number:
3052-06-0
Molecular Formula:
C9H11IN2O6
Molecular Weight:
370.0979
IUPAC Name:
1-[(2R,3S,4S,5R)-3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]-5-iodopyrimidine-2,4-dione
InChI:
InChI=1S/C9H11IN2O6/c10-3-1-12(9(17)11-7(3)16)8-6(15)5(14)4(2-13)18-8/h1,4-6,8,13-15H,2H2,(H,11,16,17)/t4-,5-,6+,8-/m1/s1
InChI Key:
RKSLVDIXBGWPIS-MNCSTQPFSA-N
SMILES:
OC[C@H]1O[C@H]([C@H]([C@@H]1O)O)n1cc(I)c(=O)[nH]c1=O
Properties
Complexity:
414
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
4
Defined Bond Stereocenter Count:
0
Exact Mass:
369.966g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
6
Hydrogen Bond Donor Count:
4
Isotope Atom Count:
0
Molecular Weight:
370.099g/mol
Monoisotopic Mass:
369.966g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
119A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-1.3
Literature
| Title | Journal |
|---|---|
| Anti-herpesvirus activity profile of 4'-thioarabinofuranosyl purine and uracil nucleosides and activity of 1-beta-D-2'-fluoro-4'-thioarabinofuranosyl guanine and 2,6-diaminopurine against clinical isolates of human cytomegalovirus. | Antiviral research 19980801 |
| Structure-activity relationship of the affinity of 5-substituted uracil nucleoside analogues for varicella-zoster virus thymidine kinase and their activity against varicella-zoster virus. | Antiviral research 19970801 |
| Antiherpes activity of (E)-5-(2-bromovinyl)- and 5-vinyl-1-beta-D-arabinofuranosyluracil and some other 5-substituted uracil arabinosyl nucleosides in two different cell lines. | Antiviral research 19830901 |
| Antiviral and antineoplastic activities of pyrimidine arabinosyl nucleosides and their 5'-amino derivatives. | Journal of medicinal chemistry 19791001 |
| Nucleosides. 110. Synthesis and antiherpes virus activity of some 2'-fluoro-2'-deoxyarabinofuranosylpyrimidine nucleosides. | Journal of medicinal chemistry 19790101 |
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