Methanol → 3-[6-[2,3-Bis(phenylmethoxy)phenyl]hexyloxy]benzoic acid
반응식
[CH3:1][O:2][C:3]([c:4]1[cH:5][c:6]([O:10][CH2:11][CH2:12][CH2:13][CH2:14][CH2:15][CH2:16][c:17]2[c:18]([O:31][CH2:32][c:33]3[cH:34][cH:35][cH:36][cH:37][cH:38]3)[c:19]([O:23][CH2:24][c:25]3[cH:26][cH:27][cH:28][cH:29][cH:30]3)[cH:20][cH:21][cH:22]2)[cH:7][cH:8][cH:9]1)=[O:39].[CH3:40][OH:41].[Na+:43].[OH-:42]>>[O:2]=[C:3]([c:4]1[cH:5][c:6]([O:10][CH2:11][CH2:12][CH2:13][CH2:14][CH2:15][CH2:16][c:17]2[c:18]([O:31][CH2:32][c:33]3[cH:34][cH:35][cH:36][cH:37][cH:38]3)[c:19]([O:23][CH2:24][c:25]3[cH:26][cH:27][cH:28][cH:29][cH:30]3)[cH:20][cH:21][cH:22]2)[cH:7][cH:8][cH:9]1)[OH:39]참가 물질
5
출처 및 근거
- ORD 기록
- ord-dcc557ea97384016be6ca091b86df10a
- 출처 데이터셋
- Training data from https://doi.org/10.1039/C8SC04228D (9/10)