Tetrahydrofuran → Acetic acid 1,1-dimethyl-2-{3-[9-methyl-2-(2-methylbenzoimidazol-1-yl)-6-morpholin-4-yl-9H-purin-8-ylmethyl]azetidin-1-yl}-2-oxoethyl ester

HRID 318135

반응식

HRID 318135 반응식
[CH2:42]1[O:43][CH2:44][CH2:45][CH2:46]1.[Cl:32][C:33](=[O:34])[C:35]([CH3:36])([CH3:37])[O:38][C:39]([CH3:40])=[O:41].[NH:1]1[CH2:2][CH:3]([CH2:5][c:6]2[n:7]([CH3:31])[c:8]3[n:9][c:10](-[n:21]4[c:22]([CH3:30])[n:23][c:24]5[c:25]4[cH:26][cH:27][cH:28][cH:29]5)[n:11][c:12]([N:15]4[CH2:16][CH2:17][O:18][CH2:19][CH2:20]4)[c:13]3[n:14]2)[CH2:4]1>>[N:1]1([C:33](=[O:34])[C:35]([CH3:36])([CH3:37])[O:38][C:39]([CH3:40])=[O:41])[CH2:2][CH:3]([CH2:5][c:6]2[n:7]([CH3:31])[c:8]3[n:9][c:10](-[n:21]4[c:22]([CH3:30])[n:23][c:24]5[c:25]4[cH:26][cH:27][cH:28][cH:29]5)[n:11][c:12]([N:15]4[CH2:16][CH2:17][O:18][CH2:19][CH2:20]4)[c:13]3[n:14]2)[CH2:4]1

참가 물질

4

반응물 3

HCID 8028TetrahydrofuranHCID 1234962-Acetoxyisobutyroyl chlorideHCID 596054598-Azetidin-3-ylmethyl-2-(2-methylbenzoimidazol-1-yl)-9-methyl-6-morpholin-4-yl-9H-purine

생성물 1

HCID 59606028Acetic acid 1,1-dimethyl-2-{3-[9-methyl-2-(2-methylbenzoimidazol-1-yl)-6-morpholin-4-yl-9H-purin-8-ylmethyl]azetidin-1-yl}-2-oxoethyl ester

출처 및 근거

ORD 기록
ord-9f45085d37cf40239e1ac228b9aaa81d
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (8/10)

연결된 노트

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