Acetic Acid → HCID 67973461, 화합물
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[C:1](=[O:2])([CH3:3])[O:4][c:5]1[c:6]([Br:18])[cH:7][c:8]([N:11]2[CH2:12][CH2:13][N:14]([CH3:17])[CH2:15][CH2:16]2)[cH:9][cH:10]1.[CH3:21][C:22](=[O:23])[OH:24].[CH3:25][OH:26].[Na+:20].[OH-:19]>>[OH:4][c:5]1[c:6]([Br:18])[cH:7][c:8]([N:11]2[CH2:12][CH2:13][N:14]([CH3:17])[CH2:15][CH2:16]2)[cH:9][cH:10]1참가 물질
6
출처 및 근거
- ORD 기록
- ord-cff5199f3e2f4d1badf7b290125475a0
- 출처 데이터셋
- Training data from https://doi.org/10.1039/C8SC04228D (8/10)
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