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HRID 600674作成日:2026年10月26日
Acetonitrile → 9-[(2R)2-Deoxy-3,5-di-O-isobutyryl-2-C-ethynyl-2-fluoro-beta-D-erythro-pentofuranosyl]guanine
https://huagongshe.com/reaction/600674
関与物質
| 役割 | 名称 | HCID | 仕込み量 |
|---|
| 反応物 | Acetonitrile | HCID 6342 | — |
| 反応物 | Isobutyric anhydride | HCID 7346 | — |
| 反応物 | Triethylamine | HCID 8471 | — |
| 反応物 | Sodium Bicarbonate | HCID 516892 | — |
| 反応物 | 9-[(2R)-2-Deoxy-2-C-ethynyl-2-fluoro-beta-D-erythro-furanosyl]-guanine | HCID 136343928 | — |
| 触媒 | 4-(Dimethylamino)pyridine | HCID 14284 | — |
| 溶媒 | Ethyl Acetate | HCID 8857 | — |
| 生成物 | 9-[(2R)2-Deoxy-3,5-di-O-isobutyryl-2-C-ethynyl-2-fluoro-beta-D-erythro-pentofuranosyl]guanine | HCID 136195920 | — |
反応手順
A solution of 9-[(2R)-2-Deoxy-2-C-ethynyl-2-fluoro-β-D-erythro-furanosyl]guanine (0.16 mmol), 4-dimethylaminopyridine (0.01 mmol), triethylamine (0.48 mmol) and isobutyric anhydride (0.48 mmol), in acetonitrile (1 ml) was stirred at room temperature for 6 hours. The reaction mixture was hydrolysed with a NaHCO3 saturated solution. Ethyl acetate was added. The organic phase was separated, washed with NaCl saturated solution, dried over Na2SO4, filtered and concentrated under reduced pressure. The crude material was purified by flash column chromatography (DCM/EtOH) to yield the title compound White powder. Molecular Formula C20H24FN5O6 1H NMR (DMSO-d6, 400 MHz) δ (ppm) 1.02-1.22 (m, 12H), 2.53-2.59 (m, 1H), 2.65-2.70 (m, 1H), 4.04 (d, J=4.77 Hz, 1H), 4.35-4.40 (m, 3H), 5.88-5.94 (dd, J=9.39 Hz and J=8.21 Hz, 1H), 6.21-6.25 (d, J=17.28 Hz, 1H), 6.58 (s, 2H), 7.09 (s, 1H), 10.82 (s, 1H). Scan ES+ 450.0 (M+H)+, UV λmax 251 nm
情報源と証拠
| DOI | 10.6084/m9.figshare.5104873.v1 |
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| 特許番号 | US07902202B2 |
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| 出典データセット | uspto-grants-2011_03 |
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| ORD ID | ord-79eac44830d444aa93a7dcd538513200 |
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| 出典メモ | uspto-grants-2011_03 |
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