Acetic Acid → HCID 59797442, 화합물
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[Br:1][c:2]1[c:3]2[c:12]([cH:13][cH:14][cH:15]1)[CH2:11][c:10]1[c:5]([cH:6][cH:7][c:8]([N+:16]([O-:17])=[O:18])[cH:9]1)[S:4]2.[CH3:19][C:20](=[O:21])[OH:22]>>[Br:1][c:2]1[c:3]2[c:12]([cH:13][cH:14][cH:15]1)[CH2:11][c:10]1[c:5]([cH:6][cH:7][c:8]([NH2:16])[cH:9]1)[S:4]2참가 물질
3
출처 및 근거
- ORD 기록
- ord-0a661b85ad9e4c64917cade7c44393a7
- 출처 데이터셋
- Training data from https://doi.org/10.1039/C8SC04228D (7/10)
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