Water → HCID 54464717, 화합물
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[Br:1][c:2]1[c:3]([C:8]([CH2:9][CH3:10])=[O:11])[cH:4][cH:5][cH:6][cH:7]1.[CH3:19][CH2:20][N:21]([CH2:22][CH3:23])[CH2:24][CH3:25].[CH3:27][c:28]1[cH:29][cH:30][cH:31][cH:32][cH:33]1.[NH2:12][c:13]1[cH:14][cH:15][cH:16][cH:17][cH:18]1.[OH2:26]>>[c:2]1([NH:12][c:13]2[cH:14][cH:15][cH:16][cH:17][cH:18]2)[c:3]([C:8]([CH2:9][CH3:10])=[O:11])[cH:4][cH:5][cH:6][cH:7]1참가 물질
6
출처 및 근거
- ORD 기록
- ord-3345dc279bd24d8f99998a69eea104e2
- 출처 데이터셋
- Training data from https://doi.org/10.1039/C8SC04228D (4/10)
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