Methanol → 1-[[2-[4-(1H-Imidazol-1-yl)phenoxy]ethyl](phenylmethyl)amino]-3-(3-methylphenoxy)-2-propanol
반응식
[CH3:1][c:2]1[cH:3][c:4]([O:8][CH2:9][CH:10]2[CH2:11][O:12]2)[cH:5][cH:6][cH:7]1.[CH3:35][OH:36].[n:13]1(-[c:18]2[cH:19][cH:20][c:21]([O:22][CH2:23][CH2:24][NH:25][CH2:26][c:27]3[cH:28][cH:29][cH:30][cH:31][cH:32]3)[cH:33][cH:34]2)[cH:14][n:15][cH:16][cH:17]1>>[CH3:1][c:2]1[cH:3][c:4]([O:8][CH2:9][CH:10]([CH2:11][N:25]([CH2:24][CH2:23][O:22][c:21]2[cH:20][cH:19][c:18](-[n:13]3[cH:14][n:15][cH:16][cH:17]3)[cH:34][cH:33]2)[CH2:26][c:27]2[cH:28][cH:29][cH:30][cH:31][cH:32]2)[OH:12])[cH:5][cH:6][cH:7]1참가 물질
4
출처 및 근거
- ORD 기록
- ord-6a426e3a06df4a5e987c6492a3085248
- 출처 데이터셋
- Training data from https://doi.org/10.1039/C8SC04228D (9/10)
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