Water → HCID 58444590, 화합물
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[Br:1][CH:2]1[CH2:3][CH:4]([c:10]2[cH:11][c:12]([F:25])[c:13]([B:16]3[O:17][C:18]([CH3:23])([CH3:24])[C:19]([CH3:21])([CH3:22])[O:20]3)[cH:14][cH:15]2)[O:5][CH2:6][CH:7]1[CH2:8][CH3:9].[CH3:28][CH2:29][N:30]([CH2:31][CH3:32])[CH2:33][CH3:34].[H:26][H:27].[OH2:35].[c:36]1([CH3:37])[cH:38][cH:39][cH:40][cH:41][cH:42]1>>[CH2:2]1[CH2:3][CH:4]([c:10]2[cH:11][c:12]([F:25])[c:13]([B:16]3[O:17][C:18]([CH3:23])([CH3:24])[C:19]([CH3:21])([CH3:22])[O:20]3)[cH:14][cH:15]2)[O:5][CH2:6][CH:7]1[CH2:8][CH3:9]참가 물질
6
출처 및 근거
- ORD 기록
- ord-9ac29d7fd3aa4f8f9065b99629632fb5
- 출처 데이터셋
- Training data from https://doi.org/10.1039/C8SC04228D (2/10)
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