Ethanol → HCID 50897818, 화합물

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[CH3:42][CH2:43][OH:44].[CH:1](=[O:2])[c:3]1[cH:4][cH:5][c:6]([O:23][CH3:24])[c:7]([CH2:8][O:9][c:10]2[c:11]([CH3:21])[cH:12][c:13]([NH:17][C:18]([CH3:19])=[O:20])[cH:14][c:15]2[CH3:16])[cH:22]1.[NH2:25][c:26]1[c:27]([C:28](=[O:29])[NH:30][CH2:31][c:32]2[cH:33][n:34][cH:35][cH:36][cH:37]2)[cH:38][cH:39][cH:40][cH:41]1>>[CH:1]1([c:3]2[cH:4][cH:5][c:6]([O:23][CH3:24])[c:7]([CH2:8][O:9][c:10]3[c:11]([CH3:21])[cH:12][c:13]([NH:17][C:18]([CH3:19])=[O:20])[cH:14][c:15]3[CH3:16])[cH:22]2)[NH:25][c:26]2[c:27]([cH:38][cH:39][cH:40][cH:41]2)[C:28](=[O:29])[N:30]1[CH2:31][c:32]1[cH:33][n:34][cH:35][cH:36][cH:37]1

참가 물질

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HCID 702Ethanol

HCID 28031922-amino-N-[(pyridin-3-yl)methyl]benzamide

HCID 86674670HCID 86674670, 화합물

생성물 1

HCID 50897818HCID 50897818, 화합물

출처 및 근거

ORD 기록: ord-9ccc9a63926847159c1a7133a8e1b079
출처 데이터셋: Training data from https://doi.org/10.1039/C8SC04228D (6/10)
DOI: 10.1039/C8SC04228D

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