Acetate → HCID 178508702, 화합물
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[Br:1][c:2]1[cH:3][c:4]2[c:8]([cH:9][cH:10]1)[N:7]([C:11]([CH2:12][c:13]1[cH:14][cH:15][cH:16][cH:17][cH:18]1)=[O:19])[CH2:6][CH2:5]2.[Br:25][c:26]1[n:27][nH:28][c:29]2[n:30][cH:31][n:32][c:33]([NH2:35])[c:34]12.[CH2:41]1[O:42][CH2:43][CH2:44][O:45][CH2:46]1.[CH3:21][C:22](=[O:23])[O-:24].[K+:20].[Na+:40].[O-:36][C:37]([OH:38])=[O:39]>>[c:2]1(-[c:26]2[n:27][nH:28][c:29]3[n:30][cH:31][n:32][c:33]([NH2:35])[c:34]23)[cH:3][c:4]2[c:8]([cH:9][cH:10]1)[N:7]([C:11]([CH2:12][c:13]1[cH:14][cH:15][cH:16][cH:17][cH:18]1)=[O:19])[CH2:6][CH2:5]2참가 물질
8
출처 및 근거
- ORD 기록
- ord-d3f48a58f43444118b423ac8d08458d3
- 출처 데이터셋
- Training data from https://doi.org/10.1039/C8SC04228D (5/10)
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