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[C:45](=[O:46])([O-:47])[O-:48].[CH3:52][CH2:53][OH:54].[CH3:55][c:56]1[cH:57][cH:58][cH:59][cH:60][cH:61]1.[Cl:1][c:2]1[c:3]2[n:11][c:10](-[c:12]3[cH:13][cH:14][cH:15][cH:16][cH:17]3)[cH:9][c:4]-2[nH:5][c:6]([CH3:8])[n:7]1.[Na+:49].[Na+:50].[OH2:51].[c:26]1([P:27]([c:28]2[cH:29][cH:30][cH:31][cH:32][cH:33]2)[c:34]2[cH:35][cH:36][cH:37][cH:38][cH:39]2)[cH:40][cH:41][cH:42][cH:43][cH:44]1.[s:18]1[cH:19][c:20]([B:23]([OH:24])[OH:25])[cH:21][cH:22]1>>[c:2]1(-[c:20]2[cH:19][s:18][cH:22][cH:21]2)[c:3]2[n:11][c:10](-[c:12]3[cH:13][cH:14][cH:15][cH:16][cH:17]3)[cH:9][c:4]-2[nH:5][c:6]([CH3:8])[n:7]1참가 물질
9
출처 및 근거
- ORD 기록
- ord-85d20be2551643628b28d0cf4d8f1da2
- 출처 데이터셋
- Training data from https://doi.org/10.1039/C8SC04228D (2/10)
연결된 노트
불러오는 중…