Ethanol → HCID 53685543, 화합물

HRID 2330678노트

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HRID 2330678 반응식
[C:1]([c:2]1[cH:3][cH:4][cH:5][cH:6][cH:7]1)([c:8]1[cH:9][cH:10][cH:11][cH:12][cH:13]1)([c:14]1[cH:15][cH:16][cH:17][cH:18][cH:19]1)[NH:20][c:21]1[s:22][cH:23][c:24]([CH:26]=[O:27])[n:25]1.[CH2:43]1[CH2:44][CH2:45][NH:46][CH2:47][CH2:48]1.[CH3:49][CH2:50][OH:51].[O:28]=[C:29]1[S:30][CH2:31][C:32](=[O:42])[N:33]1[CH2:34][C:35](=[O:36])[O:37][C:38]([CH3:39])([CH3:40])[CH3:41]>>[C:1]([c:2]1[cH:3][cH:4][cH:5][cH:6][cH:7]1)([c:8]1[cH:9][cH:10][cH:11][cH:12][cH:13]1)([c:14]1[cH:15][cH:16][cH:17][cH:18][cH:19]1)[NH:20][c:21]1[s:22][cH:23][c:24]([CH:26]=[C:31]2[S:30][C:29](=[O:28])[N:33]([CH2:34][C:35](=[O:36])[O:37][C:38]([CH3:39])([CH3:40])[CH3:41])[C:32]2=[O:42])[n:25]1

참가 물질

5

출처 및 근거

ORD 기록
ord-c6e13e11c6f8427b98af7b72cb5caa09
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (10/10)

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