5-Bromouridine triphosphate

[[(2R,3S,4R)-5-(5-bromo-2,4-dioxopyrimidin-1-yl)-3,4-dihydroxyoxolan-2-yl]methoxy-hydroxyphosphoryl] phosphono hydrogen phosphate

Also Known As: 5-Br-Utp|5-Bromo-utp|5-bromouridine triphosphate|BrUTP-5|5-bromouridine-5'-triphosphate|5-bromouridine 5'-(tetrahydrogen triphosphate)|Uridine 5'-(tetrahydrogen triphosphate), 5-bromo-|N0001-007689|[[(2R,3S,4R)-5-(5-bromo-2,4-dioxopyrimidin-1-yl)-3,4-dihydroxyoxolan-2-yl]methoxy-hydroxyphosphoryl] phosphono hydrogen phosphate|5-Bromo-4-hydroxy-1-[5-O-(hydroxy{[hydroxy(phosphonooxy)phosphoryl]oxy}phosphoryl)-D-ribofuranosyl]pyrimidin-2(1H)-one|5-Bromo-4-hydroxy-1-[5-O-(hydroxy{[hydroxy(phosphonooxy)phosphoryl]oxy}phosphoryl)pentofuranosyl]pyrimidin-2(1H)-one

Molecular Formula	C9H14BrN2O15P3
Molecular Weight	561.879 g/mol
LogP	-1.74
Topological Polar Surface Area	264.37 Ų
Hydrogen Bond Donors	7
Hydrogen Bond Acceptors	12
Rotatable Bonds	8
Exact Mass	561.879
Heavy Atoms	30
Complexity	1048.5

Chemical Identifiers

CAS Number	3398-50-3
SMILES	C1=C(C(=O)NC(=O)N1C2[C@@H]([C@@H]([C@H](O2)COP(=O)(O)OP(=O)(O)OP(=O)(O)O)O)O)Br