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Methanol → 4-Methyl-2-{5-[1-(3-methyl-butyl)-piperidin-4-yl]-4'-trifluoromethyl-biphenyl-3-yl}-pentanoic acid

HRID 306848
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인쇄 미리보기

반응식

HRID 306848 반응식
[CH2:1]([CH3:2])[O:3][C:4]([CH:5]([CH2:6][CH:7]([CH3:8])[CH3:9])[c:10]1[cH:11][c:12](-[c:27]2[cH:28][cH:29][c:30]([C:33]([F:34])([F:35])[F:36])[cH:31][cH:32]2)[cH:13][c:14]([CH:16]2[CH2:17][CH2:18][N:19]([CH2:22][CH2:23][CH:24]([CH3:25])[CH3:26])[CH2:20][CH2:21]2)[cH:15]1)=[O:37].[CH3:40][OH:41].[Na+:39].[OH-:38]>>[O:3]=[C:4]([CH:5]([CH2:6][CH:7]([CH3:8])[CH3:9])[c:10]1[cH:11][c:12](-[c:27]2[cH:28][cH:29][c:30]([C:33]([F:34])([F:35])[F:36])[cH:31][cH:32]2)[cH:13][c:14]([CH:16]2[CH2:17][CH2:18][N:19]([CH2:22][CH2:23][CH:24]([CH3:25])[CH3:26])[CH2:20][CH2:21]2)[cH:15]1)[OH:37]
참가 물질출처 및 근거반응 노트

참가 물질

5

반응물 4

HCID 887MethanolHCID 923Sodium IonHCID 961HydroxideHCID 576660704-Methyl-2-{5-[1-(3-methyl-butyl)-piperidin-4-yl]-4'-trifluoromethyl-biphenyl-3-yl}-pentanoic acid ethyl ester

생성물 1

HCID 252672874-Methyl-2-{5-[1-(3-methyl-butyl)-piperidin-4-yl]-4'-trifluoromethyl-biphenyl-3-yl}-pentanoic acid

출처 및 근거

ORD 기록
ord-f107d78e1f4b4ffb9c8a2950ad396b02
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (8/10)
DOI
10.1039/C8SC04228D

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