Bicarbonate Ion → 4-{4-[(Tert-butoxycarbonyl)(methyl)amino]butanoyl}benzyl methanesulfonate
반응식
[CH3:23][CH2:24][N:25]([CH2:26][CH3:27])[CH2:28][CH3:29].[CH3:30][S:31]([Cl:32])(=[O:33])=[O:34].[Cl:40][CH2:41][Cl:42].[Na+:35].[OH:1][CH2:2][c:3]1[cH:4][cH:5][c:6]([C:9]([CH2:10][CH2:11][CH2:12][N:13]([C:14]([O:15][C:16]([CH3:17])([CH3:18])[CH3:19])=[O:20])[CH3:21])=[O:22])[cH:7][cH:8]1.[OH:36][C:37](=[O:38])[O-:39]>>[O:1]([CH2:2][c:3]1[cH:4][cH:5][c:6]([C:9]([CH2:10][CH2:11][CH2:12][N:13]([C:14]([O:15][C:16]([CH3:17])([CH3:18])[CH3:19])=[O:20])[CH3:21])=[O:22])[cH:7][cH:8]1)[S:31]([CH3:30])(=[O:33])=[O:34]참가 물질
7
출처 및 근거
- ORD 기록
- ord-4700b0e1bd9e42fcaebd2d10c96fcfcb
- 출처 데이터셋
- Training data from https://doi.org/10.1039/C8SC04228D (3/10)
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