Acetic Acid → HCID 59578055, 화합물
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[C:1]([OH:2])(=[O:3])[CH3:4].[CH3:27][O:28][C:29]([c:30]1[c:31]([S:37](=[O:38])(=[O:39])[Cl:40])[c:32]([CH3:36])[cH:33][cH:34][cH:35]1)=[O:41].[F:5][C:6]([O:7][c:8]1[cH:9][cH:10][c:11]([N:14]2[C:15](=[O:24])[C:16]3([CH2:17][CH2:18]2)[CH2:19][CH2:20][NH:21][CH2:22][CH2:23]3)[cH:12][cH:13]1)([F:25])[F:26]>>[F:5][C:6]([O:7][c:8]1[cH:9][cH:10][c:11]([N:14]2[C:15](=[O:24])[C:16]3([CH2:17][CH2:18]2)[CH2:19][CH2:20][N:21]([S:37]([c:31]2[c:30]([C:29]([O:28][CH3:27])=[O:41])[cH:35][cH:34][cH:33][c:32]2[CH3:36])(=[O:38])=[O:39])[CH2:22][CH2:23]3)[cH:12][cH:13]1)([F:25])[F:26]참가 물질
4
출처 및 근거
- ORD 기록
- ord-eaf942eb71ed450f8d5d3bbfff37262a
- 출처 데이터셋
- Training data from https://doi.org/10.1039/C8SC04228D (7/10)
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