Bromide ion → {7-[4-(4-Methoxy-benzyloxy)-benzylsulfanyl]-indan-4-yloxy}-acetic Acid
반응식
[Br-:34].[CH3:1][O:2][C:3]([CH2:4][O:5][c:6]1[c:7]2[c:11]([c:12]([S:15][CH2:16][c:17]3[cH:18][cH:19][c:20]([O:23][CH2:24][c:25]4[cH:26][cH:27][c:28]([O:31][CH3:32])[cH:29][cH:30]4)[cH:21][cH:22]3)[cH:13][cH:14]1)[CH2:10][CH2:9][CH2:8]2)=[O:33].[K+:35]>>[O:2]=[C:3]([CH2:4][O:5][c:6]1[c:7]2[c:11]([c:12]([S:15][CH2:16][c:17]3[cH:18][cH:19][c:20]([O:23][CH2:24][c:25]4[cH:26][cH:27][c:28]([O:31][CH3:32])[cH:29][cH:30]4)[cH:21][cH:22]3)[cH:13][cH:14]1)[CH2:10][CH2:9][CH2:8]2)[OH:33]참가 물질
4
출처 및 근거
- ORD 기록
- ord-316d3391a4e947809cc761c478ac16ae
- 출처 데이터셋
- Training data from https://doi.org/10.1039/C8SC04228D (2/10)
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