Ethanol → HCID 21935514, 화합물
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[Br:22][CH2:23][CH2:24][N:25]1[C:26](=[O:35])[c:27]2[c:28]([cH:31][cH:32][cH:33][cH:34]2)[C:29]1=[O:30].[CH3:1][c:2]1[s:3][c:4]2[c:5]([n:6]1)[cH:7][c:8]([O:11][CH2:12][CH:13]([CH2:14][N:15]1[CH2:16][CH2:17][NH:18][CH2:19][CH2:20]1)[OH:21])[cH:9][cH:10]2.[CH3:36][CH2:37][N:38]([CH2:39][CH3:40])[CH2:41][CH3:42].[CH3:43][CH2:44][OH:45]>>[CH3:1][c:2]1[s:3][c:4]2[c:5]([n:6]1)[cH:7][c:8]([O:11][CH2:12][CH:13]([CH2:14][N:15]1[CH2:16][CH2:17][N:18]([CH2:23][CH2:24][N:25]3[C:26](=[O:35])[c:27]4[c:28]([cH:31][cH:32][cH:33][cH:34]4)[C:29]3=[O:30])[CH2:19][CH2:20]1)[OH:21])[cH:9][cH:10]2참가 물질
5
출처 및 근거
- ORD 기록
- ord-850982e2e43144eeb59086d63aff9b96
- 출처 데이터셋
- Training data from https://doi.org/10.1039/C8SC04228D (4/10)