Hydroxide → 1h-Indole-1-acetic acid,4-[2-[2-methyl-6-[4-(trifluoromethyl)phenyl]-3-pyridinyl]ethoxy]-

반응식

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

참가 물질

반응물 3

HCID 961Hydroxide

HCID 28486Lithium Cation

HCID 696377261h-Indole-1-acetic acid,4-[2-[2-methyl-6-[4-(trifluoromethyl)phenyl]-3-pyridinyl]ethoxy]-,ethyl ester

생성물 1

HCID 114538181h-Indole-1-acetic acid,4-[2-[2-methyl-6-[4-(trifluoromethyl)phenyl]-3-pyridinyl]ethoxy]-

출처 및 근거

ORD 기록: ord-ae8faa8d679a4774a0f2cc1841562b6e
출처 데이터셋: Training data from https://doi.org/10.1039/C8SC04228D (6/10)
DOI: 10.1039/C8SC04228D

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