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4'-C-Fluoro-2'-C-methyladenosine 5'-(tetrahydrogen triphosphate)

Catalog No. : NC290880

CAS No. : 1643968-84-6

Product Level :

Brand : NewCan Bio

Molecular Formula : C₁₁H₁₇FN₅O₁₃P₃

Chemical Name : 4'-C-Fluoro-2'-C-methyladenosine 5'-(tetrahydrogen triphosphate)

Molecular Weight : 539.20

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Basic information

Standard English name
Cas No.	1643968-84-6
Alias	(((2S,3S,4R,5R)-5-(6-amino-9H-purin-9-yl)-2-fluoro-3,4-dihydroxy-4-methyltetrahydrofuran-2-yl)methyl)triphosphoric acid
Canonical Smiles	C[C@@]1(O)[C@H](O)[C@@](F)(COP(O)(=O)OP(O)(=O)OP(O)(O)=O)O[C@H]1N1C=NC2=C(N)N=CN=C12
MDL No.
Exact Mass	539.00197
Smiles	O[C@@H]([C@@]([C@H](N1C=NC2=C(N=CN=C21)N)O3)(C)O)[C@@]3(F)COP(O)(OP(OP(O)(O)=O)(O)=O)=O

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Inchi	InChI=1S/C11H17FN5O13P3/c1-10(19)8(18)11(12,2-27-32(23,24)30-33(25,26)29-31(20,21)22)28-9(10)17-4-16-5-6(13)14-3-15-7(5)17/h3-4,8-9,18-19H,2H2,1H3,(H,23,24)(H,25,26)(H2,13,14,15)(H2,20,21,22)/t8-,9+,10+,11+/m0/s1
InchiKey	IMZCRXAZKKSPJD-LNFKQOIKSA-N
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