Dimethyl Sulfoxide → 8-(3-Aminoazepan-1-yl)-7-(2-bromobenzyl)-3-methyl-3,7-dihydropurine-2,6-dione
반응식
[Br:1][c:2]1[n:3][c:4]2[n:5]([CH3:21])[c:6](=[O:20])[nH:7][c:8](=[O:19])[c:9]2[n:10]1[CH2:11][c:12]1[c:13]([Br:18])[cH:14][cH:15][cH:16][cH:17]1.[CH3:30][CH2:31][N:32]([CH2:33][CH3:34])[CH2:35][CH3:36].[CH3:37][S:38]([CH3:39])=[O:40].[NH:22]1[CH2:23][CH:24]([NH2:29])[CH2:25][CH2:26][CH2:27][CH2:28]1>>[c:2]1([N:22]2[CH2:23][CH:24]([NH2:29])[CH2:25][CH2:26][CH2:27][CH2:28]2)[n:3][c:4]2[n:5]([CH3:21])[c:6](=[O:20])[nH:7][c:8](=[O:19])[c:9]2[n:10]1[CH2:11][c:12]1[c:13]([Br:18])[cH:14][cH:15][cH:16][cH:17]1참가 물질
5
출처 및 근거
- ORD 기록
- ord-61a4b7b87cff4a47b4189785bd8ad3ab
- 출처 데이터셋
- Training data from https://doi.org/10.1039/C8SC04228D (1/10)
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