Hydroxide → 2-Ethoxy-3-[4-[[2-(4-fluoro-3-methylphenyl)-5-methyl-1,3-oxazol-4-yl]methoxy]-2,6-dimethylphenyl]propanoic acid

반응식

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

참가 물질

반응물 3

HCID 961Hydroxide

HCID 28486Lithium ion

HCID 69282201Methyl 2-ethoxy-3-[4-[[2-(4-fluoro-3-methylphenyl)-5-methyl-1,3-oxazol-4-yl]methoxy]-2,6-dimethylphenyl]propanoate

생성물 1

HCID 222739382-Ethoxy-3-[4-[[2-(4-fluoro-3-methylphenyl)-5-methyl-1,3-oxazol-4-yl]methoxy]-2,6-dimethylphenyl]propanoic acid

출처 및 근거

ORD 기록: ord-a912ec41d36b41a2808b0d03f31cbf09
출처 데이터셋: Training data from https://doi.org/10.1039/C8SC04228D (5/10)
DOI: 10.1039/C8SC04228D

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