Home > Product Catalog > Product category > Nucleotide > Bis[[[(1-methylethoxy)carbonyl]oxy]methyl]2'-C-ethynyl-4'-C-(fluoromethyl)-2',3'-O-(methoxymethylene)-5'-adenylate

Bis[[[(1-methylethoxy)carbonyl]oxy]methyl]2'-C-ethynyl-4'-C-(fluoromethyl)-2',3'-O-(methoxymethylene)-5'-adenylate

Catalog No. : NC16968

CAS No. : 1643585-51-6

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Brand : NewCan Bio

Molecular Formula : C₂₅H₃₃FN₅O₁₄P

Chemical Name : Bis[[[(1-methylethoxy)carbonyl]oxy]methyl]2'-C-ethynyl-4'-C-(fluoromethyl)-2',3'-O-(methoxymethylene)-5'-adenylate

Molecular Weight : 677.53

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Basic information

Standard English name
Cas No.	1643585-51-6
Alias	5'-Adenylic acid, 2'-C-ethynyl-4'-C-(fluoromethyl)-2',3'-O-(methoxymethylene)-, bis[[[(1-methylethoxy)carbonyl]oxy]methyl] ester
Canonical Smiles	COC1O[C@]2(C#C)[C@H](O1)[C@@](CF)(COP(=O)(OCOC(=O)OC(C)C)OCOC(=O)OC(C)C)O[C@H]2N1C=NC2=C(N)N=CN=C12
MDL No.
Exact Mass	677.17457
Smiles	O=P(OCOC(OC(C)C)=O)(OC[C@]1(CF)[C@H]([C@@]([C@H](N2C=NC3=C(N=CN=C32)N)O1)(C#C)O4)OC4OC)OCOC(OC(C)C)=O

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Inchi	InChI=1S/C25H33FN5O14P/c1-7-25-19(43-23(35-6)45-25)24(8-26,44-20(25)31-11-30-16-17(27)28-10-29-18(16)31)9-38-46(34,39-12-36-21(32)41-14(2)3)40-13-37-22(33)42-15(4)5/h1,10-11,14-15,19-20,23H,8-9,12-13H2,2-6H3,(H2,27,28,29)/t19-,20-,23?,24-,25-/m1/s1
InchiKey	AIYZMYMHPAYSQK-LKXNTJGUSA-N
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History

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