Acetate → HCID 178459901, 화합물
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[C:48]([O-:49])(=[O:50])[CH3:51].[C:53]([O-:54])(=[O:55])[CH3:56].[N+:1](=[N-:2])=[C:3]([C:4](=[O:5])[O:6][CH2:7][c:8]1[cH:9][cH:10][c:11]([N+:14](=[O:15])[O-:16])[cH:12][cH:13]1)[C:17]([CH2:18][CH:19]1[NH:20][C:21](=[O:40])[CH:22]1[C:23]([CH3:24])([O:25][C:26](=[O:27])[O:28][CH2:29][c:30]1[cH:31][cH:32][c:33]([N+:36](=[O:37])[O-:38])[cH:34][cH:35]1)[CH3:39])=[O:41].[Rh+2:52].[cH:42]1[cH:43][cH:44][cH:45][cH:46][cH:47]1>>[CH:3]1([C:4](=[O:5])[O:6][CH2:7][c:8]2[cH:9][cH:10][c:11]([N+:14](=[O:15])[O-:16])[cH:12][cH:13]2)[C:17](=[O:41])[CH2:18][CH:19]2[N:20]1[C:21](=[O:40])[CH:22]2[C:23]([CH3:24])([O:25][C:26](=[O:27])[O:28][CH2:29][c:30]1[cH:31][cH:32][c:33]([N+:36](=[O:37])[O-:38])[cH:34][cH:35]1)[CH3:39]참가 물질
5
출처 및 근거
- ORD 기록
- ord-69914816a98c4f859a63b7c35ab919f0
- 출처 데이터셋
- Training data from https://doi.org/10.1039/C8SC04228D (8/10)