Sodium Ion → (2-(2-(Dimethylamino)ethylamino)-3-fluorophenyl)methanol
반응식
[Al+3:19].[CH3:1][N:2]([CH2:3][CH2:4][NH:5][c:6]1[c:7]([C:8](=[O:9])[O:10][CH3:11])[cH:12][cH:13][cH:14][c:15]1[F:16])[CH3:17].[CH3:24][CH2:25][O:26][CH2:27][CH3:28].[F-:29].[H-:18].[H-:21].[H-:22].[H-:23].[Li+:20].[Na+:30].[OH2:31]>>[CH3:1][N:2]([CH2:3][CH2:4][NH:5][c:6]1[c:7]([CH2:8][OH:9])[cH:12][cH:13][cH:14][c:15]1[F:16])[CH3:17]참가 물질
9
출처 및 근거
- ORD 기록
- ord-887578e61c5b49e5968d2cb3c550c682
- 출처 데이터셋
- Training data from https://doi.org/10.1039/C8SC04228D (8/10)
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