Hydroxide → (6-{2-[2-(4-Trifluoromethyl-phenyl)-thiazol-4-yl]-ethoxy}-indol-1-yl)-acetic acid

반응식

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

참가 물질

반응물 3

HCID 961Hydroxide

HCID 28486Lithium ion

HCID 69280485(6-{2-[2-(4-Trifluoromethyl-phenyl)-thiazol-4-yl]-ethoxy]-indol-1-yl)-acetic acid tert-butyl ester

생성물 1

HCID 11293763(6-{2-[2-(4-Trifluoromethyl-phenyl)-thiazol-4-yl]-ethoxy}-indol-1-yl)-acetic acid

출처 및 근거

ORD 기록: ord-d51bcc16f11c41509fd6720e162c9ee1
출처 데이터셋: Training data from https://doi.org/10.1039/C8SC04228D (6/10)
DOI: 10.1039/C8SC04228D

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