Hydroxide → 3-[2-Chloro-4-[[2-(2-methoxyphenyl)-5-methyl-1,3-oxazol-4-yl]methoxy]phenyl]-2-ethoxypropanoic acid

반응식

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

참가 물질

반응물 3

HCID 961Hydroxide

HCID 28486Lithium ion

HCID 69280738Methyl 3-[2-chloro-4-[[2-(2-methoxyphenyl)-5-methyl-1,3-oxazol-4-yl]methoxy]phenyl]-2-ethoxypropanoate

생성물 1

HCID 222739213-[2-Chloro-4-[[2-(2-methoxyphenyl)-5-methyl-1,3-oxazol-4-yl]methoxy]phenyl]-2-ethoxypropanoic acid

출처 및 근거

ORD 기록: ord-d618a37be1ba474e936b0fa19025fca7
출처 데이터셋: Training data from https://doi.org/10.1039/C8SC04228D (9/10)
DOI: 10.1039/C8SC04228D

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