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5-Fluorouridine 5'-phosphate

CAT: 0931-T205644-01Size: 10 mgDry Ice: NoHazardous: No
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CAT#:0931-T205644-01Size:10 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
796-66-7
Target
DNA/RNA Synthesis
Related Pathways
Cell Cycle/Checkpoint, DNA Damage/DNA Repair
Bioactivity
5-Fluorouridine 5'-phosphate acts as an ODCase (uridine 5'-monophosphate decarboxylase) inhibitor, exhibiting a Ki value of 98 μM for human ODCase and 645 μM for Methanococcus jannaschii ODCase. This compound also shows inhibitory activity on leukemia and lymphoma cell lines, making it useful for cancer research studies.
Smiles
O[C@H]1[C@@H](O[C@H](COP(=O)(O)O)[C@H]1O)N2C(=O)NC(=O)C(F)=C2
Molecular Formula
C9H12FN2O9P
Molecular Weight
342.172
Shipping Conditions
Ice Packs
Storage Temperature
-20°C

Chemical Information

5-Fluorouridine 5'-monophosphate

5-fluorouridine 5'-monophosphate is a pyrimidine ribonucleoside 5'-monophosphate having 5-fluorouracil as the pyrimidine component. It has a role as a drug metabolite. It is an organofluorine compound and a pyrimidine ribonucleoside 5'-monophosphate. It is functionally related to a uridine 5'-monophosphate.

CAS Number796-66-7
PubChem CID150856
IUPAC Name[(2R,3S,4R,5R)-5-(5-fluoro-2,4-dioxopyrimidin-1-yl)-3,4-dihydroxyoxolan-2-yl]methyl dihydrogen phosphate
Molecular FormulaC9H12FN2O9P
Molecular Weight342.17
XLogP-3.6
Topological Polar Surface Area166
Hydrogen Bond Donor Count5
Hydrogen Bond Acceptor Count10
Rotatable Bond Count4
Heavy Atom Count22
Formal Charge0
Complexity563
SMILES
C1=C(C(=O)NC(=O)N1[C@H]2[C@@H]([C@@H]([C@H](O2)COP(=O)(O)O)O)O)F
InChI
InChI=1S/C9H12FN2O9P/c10-3-1-12(9(16)11-7(3)15)8-6(14)5(13)4(21-8)2-20-22(17,18)19/h1,4-6,8,13-14H,2H2,(H,11,15,16)(H2,17,18,19)/t4-,5-,6-,8-/m1/s1
InChIKey
RNBMPPYRHNWTMA-UAKXSSHOSA-N
Chemical Structure
2D Structure
2D structure of 5-Fluorouridine 5'-monophosphate
CAS: 796-66-7
CID: 150856
Formula: C9H12FN2O9P
MW: 342.17
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight342.17
XLogP3-3.6
Hydrogen Bond Donor Count5
Hydrogen Bond Acceptor Count10
Rotatable Bond Count4
Exact Mass342.02644512
Monoisotopic Mass342.02644512
Topological Polar Surface Area166 Ų
Heavy Atom Count22
Formal Charge0
Complexity563
Isotope Atom Count0
Defined Atom Stereocenter Count4
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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Alternative Products

CatalogName
HY-W784565-015-Fluorouridine 5'-phosphate
NF04076-015-Fluorouridine

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