Methanol → 1-(3-(4-Methoxyphenyl)-2,2,4,6,7-pentamethyl-2,3-dihydro-1-benzofuran-5-yl)-4-(3,4-dimethoxyphenyl)piperidine
反応式
[CH3:1][O:2][c:3]1[cH:4][cH:5][c:6]([C:9]2([OH:39])[C:10]([CH3:37])([CH3:38])[O:11][c:12]3[c:13]2[c:14]([CH3:36])[c:15]([N:20]2[CH2:21][CH2:22][CH:23]([c:26]4[cH:27][c:28]([O:34][CH3:35])[c:29]([O:32][CH3:33])[cH:30][cH:31]4)[CH2:24][CH2:25]2)[c:16]([CH3:19])[c:17]3[CH3:18])[cH:7][cH:8]1.[CH3:40][OH:41].[CH3:42][CH2:43][CH2:44][CH2:45][CH2:46][CH3:47]>>[CH3:1][O:2][c:3]1[cH:4][cH:5][c:6]([CH:9]2[C:10]([CH3:37])([CH3:38])[O:11][c:12]3[c:13]2[c:14]([CH3:36])[c:15]([N:20]2[CH2:21][CH2:22][CH:23]([c:26]4[cH:27][c:28]([O:34][CH3:35])[c:29]([O:32][CH3:33])[cH:30][cH:31]4)[CH2:24][CH2:25]2)[c:16]([CH3:19])[c:17]3[CH3:18])[cH:7][cH:8]1参加物
4
出典と根拠
- ORDレコード
- ord-a3e48ed92a054feda4f7343eccec7547
- 出典データセット
- Training data from https://doi.org/10.1039/C8SC04228D (8/10)