Sodium Ion → 1-[5-(2,6-dimethyl-phenyl)-1-(6-isopropoxy-pyridazin-3-yl)-1H-pyrrolo[2,3-c]pyridin-3-yl]-2-ethyl-butan-1-ol
反応式
[BH4-:35].[CH3:1][c:2]1[c:3](-[c:9]2[cH:10][c:11]3[c:12]([cH:13][n:14]2)[n:15](-[c:25]2[n:26][n:27][c:28]([O:31][CH:32]([CH3:33])[CH3:34])[cH:29][cH:30]2)[cH:16][c:17]3[C:18]([CH:19]([CH2:20][CH3:21])[CH2:22][CH3:23])=[O:24])[c:4]([CH3:8])[cH:5][cH:6][cH:7]1.[Na+:36]>>[CH3:1][c:2]1[c:3](-[c:9]2[cH:10][c:11]3[c:12]([cH:13][n:14]2)[n:15](-[c:25]2[n:26][n:27][c:28]([O:31][CH:32]([CH3:33])[CH3:34])[cH:29][cH:30]2)[cH:16][c:17]3[CH:18]([CH:19]([CH2:20][CH3:21])[CH2:22][CH3:23])[OH:24])[c:4]([CH3:8])[cH:5][cH:6][cH:7]1参加物
4
出典と根拠
- ORDレコード
- ord-685b1e26f1504558a9dc0f9438ce1c03
- 出典データセット
- Training data from https://doi.org/10.1039/C8SC04228D (2/10)