HRID1349985

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID233917

1-Ethynyl-3-methylcyclohexan-1-ol

C9H14O

结构：CCNC(=O)[C@H]1O[C@@H](n2cnc3c(N)nc(I)nc32)C(O)[C@H]1O

HCID45039581

(2S,3R,5R)-5-(6-Amino-2-iodo-9H-purin-9-yl)-N-ethyl-3,4-dihydroxyoxolane-2-carboxamide

C12H15IN6O4

PRODUCTS

生成物

结构：CCNC(=O)C1OC(n2cnc3c(N)nc(C#CC4(O)CCCC(C)C4)nc32)C(O)C1O

HCID67280272

未命名化合物

PROCEDURE

实验过程

The reaction of 1-Ethynyl-3-methyl-cyclohexanol (JR3149B) (100 mg, 0.72 mmol) with 2-iodo-NECA (25 mg, 0.06 mmol) under the general coupling conditions gave JR3179 (15.0 mg, 59%) as a white solid after purification by a silica plug and RP-HPLC. 1H NMR (CD3OD-d4) δ 8.49 (s, 1H), 6.06 (d, J=6.9 Hz, 1H), 4.75 (dd, J=6.4 Hz, J=4.9 Hz, 1H), 4.46 (d, J=1.9 Hz, 1H), 4.34 (dd, J=4.9 Hz, J=2.1 Hz, 1H), 3.42 (m, 2H), 2.09 (d, J=12.3 Hz, 2H), 1.73 (m, 4H), 1.46 (m, 1H), 1.23 (m, 1H), 1.169 (t, J=7.1 Hz, 3H), 0.95 (d, J=6.2 Hz, 3H), 0.89 (m, 1H). 13C NMR (CD3OD-d4) δ. APCI m/z (rel intensity) 445.3 (MH+, 100), 427.4(40), 254.4(4).

WORKUP

后处理

customgave JR3179 (15.0 mg, 59%) as a white solid
customafter purification by a silica plug and RP-HPLC