Ethanol → HCID 21104595, 화합물

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

참가 물질

반응물 3

HCID 702Ethanol

HCID 11298596HCID 11298596, 화합물

HCID 21104576HCID 21104576, 화합물

생성물 1

HCID 21104595HCID 21104595, 화합물

출처 및 근거

ORD 기록: ord-b5bbdf45798949e3a796543cb3a49bd4
출처 데이터셋: Training data from https://doi.org/10.1039/C8SC04228D (3/10)
DOI: 10.1039/C8SC04228D

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