2'-Fluoro-2'-deoxyadenosine triphosphate

[[(2R,3R,4R,5R)-5-(6-aminopurin-9-yl)-4-fluoro-3-hydroxyoxolan-2-yl]methoxy-hydroxyphosphoryl] phosphono hydrogen phosphate

Also Known As: 2-Fluoro-datp|2-Dfladtp|2'-FdATP|2'-Deoxy-2'-fluoroadenosine triphosphate|2'-Fluoro-2'-deoxyadenosine triphosphate|2'-Deoxy-2'-fluoroadenosine-5'-triphosphate|CAS 73449-07-7|2'-Deoxy-2'-fluoroadenosine 5'-Triphosphate|J1.320.586H|2'-Deoxy-2'-fluoro-D-adenosine-5'-triphosphate|Adenosine 5'-(tetrahydrogen triphosphate), 2'-deoxy-2'-fluoro-|2'-deoxy-2'-fluoroadenosine 5'-(tetrahydrogen triphosphate)|[[(2R,3R,4R,5R)-5-(6-aminopurin-9-yl)-4-fluoro-3-hydroxyoxolan-2-yl]methoxy-hydroxyphosphoryl] phosphono hydrogen phosphate|2 -Fluoro-2 -deoxyadenosine 5 -triphosphoric acid|(((2R,3R,4R,5R)-5-(6-amino-9H-purin-9-yl)-4-fluoro-3-hydroxytetrahydrofuran-2-yl)methyl)triphosphoric acid|((2R,3R,4R,5R)-5-(6-Amino-9H-purin-9-yl)-4-fluoro-3-hydroxytetrahydrofuran-2-yl)methyl tetrahydrogen triphosphate|({[({[(2R,3R,4R,5R)-5-(6-amino-9H-purin-9-yl)-4-fluoro-3-hydroxyoxolan-2-yl]methoxy}(hydroxy)phosphoryl)oxy](hydroxy)phosphoryl}oxy)phosphonic acid|[(2r,3r,4r,5r)-5-(6-aminopurin-9-yl)-4-fluoro-3-hydroxyoxolan-2-yl]methyl (hydroxy-phosphonooxyphosphoryl) hydrogen phosphate|[[(2~{R},3~{R},4~{R},5~{R})-5-(6-aminopurin-9-yl)-4-fluoranyl-3-oxidanyl-oxolan-2-yl]methoxy-oxidanyl-phosphoryl] phosphono hydrogen phosphate|9-[2-Deoxy-2-fluoro-5-O-(hydroxy{[hydroxy(phosphonooxy)phosphoryl]oxy}phosphoryl)pentofuranosyl]-9H-purin-6-amine|YGC

Molecular Formula	C10H15FN5O12P3
Molecular Weight	508.99142 g/mol
LogP	-4.7
Topological Polar Surface Area	259.0 Ų
Hydrogen Bond Donors	6
Hydrogen Bond Acceptors	17
Rotatable Bonds	8
Exact Mass	508.99142
Monoisotopic Mass	508.99142
Heavy Atoms	31
Complexity	805.0

Chemical Identifiers

CAS Number	76403-90-2
SMILES	C1=NC(=C2C(=N1)N(C=N2)[C@H]3[C@@H]([C@@H]([C@H](O3)COP(=O)(O)OP(=O)(O)OP(=O)(O)O)O)F)N
InChIKey	CCXCDDWASROAJA-QYYRPYCUSA-N