(4-Amino-7-cyclopentyl-7H-pyrrolo[2,3-d]pyrimidin-5-yl)-(3-nitro-phenyl)methanone → {3-[3-(4-Amino-7-cyclopentyl-7H-pyrrolo[2,3-d]pyrimidine-5-carbonyl)-phenyl]-prop-2-ynyl}-carbamic acid tert-butyl ester
반응식
[C:1]([CH3:2])([CH3:3])([CH3:4])[O:5][C:6]([NH:7][CH2:8][C:9]#[C:10][c:11]1[cH:12][c:13]([C:17](=[O:18])[c:19]2[cH:20][n:21]([CH:29]3[CH2:30][CH2:31][CH2:32][CH2:33]3)[c:22]3[n:23][cH:24][n:25][c:26]([Cl:28])[c:27]23)[cH:14][cH:15][cH:16]1)=[O:34].[NH2:35][c:36]1[c:37]2[c:38]([C:39]([c:40]3[cH:41][cH:42][cH:43][c:44]([N+:45]([O-:46])=[O:47])[cH:48]3)=[O:49])[cH:50][n:51]([CH:52]3[CH2:53][CH2:54][CH2:55][CH2:56]3)[c:57]2[n:58][cH:59][n:60]1>>[C:1]([CH3:2])([CH3:3])([CH3:4])[O:5][C:6]([NH:7][CH2:8][C:9]#[C:10][c:11]1[cH:12][c:13]([C:17](=[O:18])[c:19]2[cH:20][n:21]([CH:29]3[CH2:30][CH2:31][CH2:32][CH2:33]3)[c:22]3[n:23][cH:24][n:25][c:26]([NH2:35])[c:27]23)[cH:14][cH:15][cH:16]1)=[O:34]참가 물질
3
반응물 2
생성물 1
출처 및 근거
- ORD 기록
- ord-8b16e7752281476c812ec1d94a1d5c44
- 출처 데이터셋
- Training data from https://doi.org/10.1039/C8SC04228D (8/10)
- DOI