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5-Bromoarabinouridine

CAT: 0013-GTR19214694-01Size: 5 mgDry Ice: NoHazardous: No
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CAT#:0013-GTR19214694-01Size:5 mg
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Description
5-Bromoarabinouridine is a halogenated arabinonucleoside analog. It serves as a research tool in antiviral and anticancer studies, where it has been investigated in vitro for its potential to inhibit DNA synthesis and induce cell death in proliferating cells.
CAS Number
3370-69-2
Field of Research
Cell Biology, Molecular Biology
Smiles
OC[C@H]1O[C@H] ([C@@H] (O) [C@@H]1O) n1cc (Br) c (O) nc1=O
Molecular Formula
C9H11BrN2O6
Molecular Weight
323.099
Storage Conditions
-20°C
Notes
For research use only.

Chemical Information

5-Bromouracil ribonucleoside
CAS Number3370-69-2
PubChem CID236183
IUPAC Name5-bromo-1-[3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]pyrimidine-2,4-dione
Molecular FormulaC9H11BrN2O6
Molecular Weight323.10
XLogP-1.1
Topological Polar Surface Area119
Hydrogen Bond Donor Count4
Hydrogen Bond Acceptor Count6
Rotatable Bond Count2
Heavy Atom Count18
Formal Charge0
Complexity414
SMILES
C1=C(C(=O)NC(=O)N1C2C(C(C(O2)CO)O)O)Br
InChI
InChI=1S/C9H11BrN2O6/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)
InChIKey
AGFIRQJZCNVMCW-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of 5-Bromouracil ribonucleoside
CAS: 3370-69-2
CID: 236183
Formula: C9H11BrN2O6
MW: 323.10
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight323.10
XLogP3-1.1
Hydrogen Bond Donor Count4
Hydrogen Bond Acceptor Count6
Rotatable Bond Count2
Exact Mass321.98005
Monoisotopic Mass321.98005
Topological Polar Surface Area119 Ų
Heavy Atom Count18
Formal Charge0
Complexity414
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count4
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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