1-(2-Methoxyphenyl)piperazine → 8-((3-(4-(2-Methoxyphenyl)piperazin-1-yl)-2-hydroxypropyl)oxy)thiochroman
반응식
[CH3:16][O:17][c:18]1[c:19]([N:24]2[CH2:25][CH2:26][NH:27][CH2:28][CH2:29]2)[cH:20][cH:21][cH:22][cH:23]1.[O:1]1[CH:2]([CH2:3][O:4][c:5]2[cH:6][cH:7][cH:8][c:9]3[c:14]2[S:13][CH2:12][CH2:11][CH2:10]3)[CH2:15]1.[O:30]1[CH2:31][CH2:32][CH2:33][CH2:34]1>>[OH:1][CH:2]([CH2:3][O:4][c:5]1[cH:6][cH:7][cH:8][c:9]2[c:14]1[S:13][CH2:12][CH2:11][CH2:10]2)[CH2:15][N:27]1[CH2:26][CH2:25][N:24]([c:19]2[c:18]([O:17][CH3:16])[cH:23][cH:22][cH:21][cH:20]2)[CH2:29][CH2:28]1참가 물질
4
출처 및 근거
- ORD 기록
- ord-5e0e751b4fe746b4942c3bf0646b9f9a
- 출처 데이터셋
- Training data from https://doi.org/10.1039/C8SC04228D (1/10)
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