Acetic Acid → HCID 67435756, 화합물
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[Br:1][c:2]1[cH:3][c:4]([CH:12]2[C:13]([C:27]#[N:28])=[C:14]([CH3:26])[NH:15][C:16]3=[C:21]2[C:20](=[O:22])[CH2:19][CH:18]([CH2:23][CH2:24][CH3:25])[CH2:17]3)[cH:5][c:6]([N+:9]([O-:10])=[O:11])[c:7]1[OH:8].[CH2:33]1[O:34][CH2:35][CH2:36][CH2:37]1.[CH3:29][C:30](=[O:31])[OH:32].[Zn:38]>>[Br:1][c:2]1[cH:3][c:4]([CH:12]2[C:13]([C:27]#[N:28])=[C:14]([CH3:26])[NH:15][C:16]3=[C:21]2[C:20](=[O:22])[CH2:19][CH:18]([CH2:23][CH2:24][CH3:25])[CH2:17]3)[cH:5][c:6]([NH2:9])[c:7]1[OH:8]참가 물질
5
출처 및 근거
- ORD 기록
- ord-72673ef4a008447c8d621141e55e6bcd
- 출처 데이터셋
- Training data from https://doi.org/10.1039/C8SC04228D (8/10)
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