Methanol → 5-(3,4-Dimethoxy-benzyl)-7,8-dimethoxy-2,3,4,5-tetrahydro benzo[f][1,4]oxazepine
반응식
[BH4-:33].[CH3:1][O:2][c:3]1[cH:4][c:5]([O:6][CH2:7][CH2:8][NH:9][C:10]([CH2:11][c:12]2[cH:13][c:14]([O:20][CH3:21])[c:15]([O:18][CH3:19])[cH:16][cH:17]2)=[O:22])[cH:23][cH:24][c:25]1[O:26][CH3:27].[CH3:36][C:37]#[N:38].[CH3:42][OH:43].[Cl:39][CH2:40][Cl:41].[Na+:34].[OH2:35].[P:28]([Cl:29])([Cl:30])([Cl:31])=[O:32]>>[CH3:1][O:2][c:3]1[cH:4][c:5]2[c:23]([cH:24][c:25]1[O:26][CH3:27])[CH:10]([CH2:11][c:12]1[cH:13][c:14]([O:20][CH3:21])[c:15]([O:18][CH3:19])[cH:16][cH:17]1)[NH:9][CH2:8][CH2:7][O:6]2참가 물질
9
반응물 8
생성물 1
출처 및 근거
- ORD 기록
- ord-3913649c86964753995886e3dffcc8cf
- 출처 데이터셋
- Training data from https://doi.org/10.1039/C8SC04228D (2/10)
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