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Methanol → 6-(6-(3-Ethylureido)-4-(4-(trifluoromethyl)thiazol-2-yl)pyridin-3-yl)-1-(2-methoxyethyl)-4-oxo-1,4-dihydroquinoline-3-carboxylic acid

HRID 2154222
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반응식

HRID 2154222 반응식
[CH2:1]([CH3:2])[NH:3][C:4]([NH:5][c:6]1[cH:7][c:8](-[c:32]2[s:33][cH:34][c:35]([C:37]([F:38])([F:39])[F:40])[n:36]2)[c:9](-[c:12]2[cH:13][c:14]3[c:15](=[O:31])[c:16]([C:26](=[O:27])[O:28][CH2:29][CH3:30])[cH:17][n:18]([CH2:22][CH2:23][O:24][CH3:25])[c:19]3[cH:20][cH:21]2)[cH:10][n:11]1)=[O:41].[CH3:44][OH:45].[Li+:43].[OH-:42].[OH2:46]>>[CH2:1]([CH3:2])[NH:3][C:4]([NH:5][c:6]1[cH:7][c:8](-[c:32]2[s:33][cH:34][c:35]([C:37]([F:38])([F:39])[F:40])[n:36]2)[c:9](-[c:12]2[cH:13][c:14]3[c:15](=[O:31])[c:16]([C:26](=[O:27])[OH:28])[cH:17][n:18]([CH2:22][CH2:23][O:24][CH3:25])[c:19]3[cH:20][cH:21]2)[cH:10][n:11]1)=[O:41]
참가 물질출처 및 근거반응 노트

참가 물질

6

반응물 5

HCID 887MethanolHCID 961HydroxideHCID 962WaterHCID 28486Lithium ionHCID 59416012Ethyl 6-(6-(3-ethylureido)-4-(4-(trifluoromethyl)thiazol-2-yl)pyridin-3-yl)-1-(2-methoxyethyl)-4-oxo-1,4-dihydroquinoline-3-carboxylate

생성물 1

HCID 44540168
6-(6-(3-Ethylureido)-4-(4-(trifluoromethyl)thiazol-2-yl)pyridin-3-yl)-1-(2-methoxyethyl)-4-oxo-1,4-dihydroquinoline-3-carboxylic acid

출처 및 근거

ORD 기록
ord-eedfdfafacc24558b203530250c3b842
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (4/10)
DOI
10.1039/C8SC04228D

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