Methanol → 4-{4-[4-(3-Methanesulfonyl-propoxy)-indol-1-yl]-pyrimidin-2-ylamino}-cyclohexanecarboxylic acid
반응식
[CH2:1]([CH3:2])[O:3][C:4](=[O:5])[CH:6]1[CH2:7][CH2:8][CH:9]([NH:12][c:13]2[n:14][cH:15][cH:16][c:17](-[n:19]3[cH:20][cH:21][c:22]4[c:23]([O:28][CH2:29][CH2:30][CH2:31][S:32](=[O:33])(=[O:34])[CH3:35])[cH:24][cH:25][cH:26][c:27]34)[n:18]2)[CH2:10][CH2:11]1.[CH2:36]1[O:37][CH2:38][CH2:39][CH2:40]1.[CH3:41][OH:42].[OH2:43]>>[O:3]=[C:4]([OH:5])[CH:6]1[CH2:7][CH2:8][CH:9]([NH:12][c:13]2[n:14][cH:15][cH:16][c:17](-[n:19]3[cH:20][cH:21][c:22]4[c:23]([O:28][CH2:29][CH2:30][CH2:31][S:32](=[O:33])(=[O:34])[CH3:35])[cH:24][cH:25][cH:26][c:27]34)[n:18]2)[CH2:10][CH2:11]1참가 물질
5
출처 및 근거
- ORD 기록
- ord-6698cb30e9b34ae4be88df2cb854af08
- 출처 데이터셋
- Test data from https://doi.org/10.1039/C8SC04228D
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