Bicarbonate Ion → [1-[2-(4-Pyrrolidin-1-ylphenyl)ethyl]pyrrolidin-3-yl] methanesulfonate
반응식
[CH3:29][S:30]([Cl:31])(=[O:32])=[O:33].[CH:20]([N:21]([CH:22]([CH3:23])[CH3:24])[CH2:25][CH3:26])([CH3:27])[CH3:28].[Cl:39][CH2:40][Cl:41].[Na+:34].[OH:1][CH:2]1[CH2:3][N:4]([CH2:7][CH2:8][c:9]2[cH:10][cH:11][c:12]([N:15]3[CH2:16][CH2:17][CH2:18][CH2:19]3)[cH:13][cH:14]2)[CH2:5][CH2:6]1.[OH:35][C:36](=[O:37])[O-:38]>>[O:1]([CH:2]1[CH2:3][N:4]([CH2:7][CH2:8][c:9]2[cH:10][cH:11][c:12]([N:15]3[CH2:16][CH2:17][CH2:18][CH2:19]3)[cH:13][cH:14]2)[CH2:5][CH2:6]1)[S:30]([CH3:29])(=[O:32])=[O:33]참가 물질
7
출처 및 근거
- ORD 기록
- ord-775f26758fb54d6a851093990be36f74
- 출처 데이터셋
- Training data from https://doi.org/10.1039/C8SC04228D (2/10)
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