Benzene → 1-[4-[5-(Oxan-2-yloxy)pentyl]piperazin-1-yl]propan-2-ol
반응식
[CH3:1][CH:2]([CH2:3][N:4]1[CH2:5][CH2:6][NH:7][CH2:8][CH2:9]1)[OH:10].[O:11]1[CH:12]([O:17][CH2:18][CH2:19][CH2:20][CH2:21][CH2:22][Cl:23])[CH2:13][CH2:14][CH2:15][CH2:16]1.[cH:24]1[cH:25][cH:26][cH:27][cH:28][cH:29]1>>[CH3:1][CH:2]([CH2:3][N:4]1[CH2:5][CH2:6][N:7]([CH2:22][CH2:21][CH2:20][CH2:19][CH2:18][O:17][CH:12]2[O:11][CH2:16][CH2:15][CH2:14][CH2:13]2)[CH2:8][CH2:9]1)[OH:10]참가 물질
4
출처 및 근거
- ORD 기록
- ord-4a35e42b39f441c4bed2a6f552e5d84c
- 출처 데이터셋
- Training data from https://doi.org/10.1039/C8SC04228D (2/10)
반응 노트
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