Methanol → 1-(1-Benzofuran-4-yloxy)-3-[4-(6-fluoronaphthalen-2-yl)piperidin-1-yl]propan-2-ol

반응식

[CH3:32][OH:33].[F:1][c:2]1[cH:3][c:4]2[cH:5][cH:6][c:7]([CH:12]3[CH2:13][CH2:14][NH:15][CH2:16][CH2:17]3)[cH:8][c:9]2[cH:10][cH:11]1.[O:18]1[CH:19]([CH2:21][O:22][c:23]2[cH:24][cH:25][cH:26][c:27]3[o:28][cH:29][cH:30][c:31]23)[CH2:20]1>>[F:1][c:2]1[cH:3][c:4]2[cH:5][cH:6][c:7]([CH:12]3[CH2:13][CH2:14][N:15]([CH2:20][CH:19]([OH:18])[CH2:21][O:22][c:23]4[cH:24][cH:25][cH:26][c:27]5[o:28][cH:29][cH:30][c:31]45)[CH2:16][CH2:17]3)[cH:8][c:9]2[cH:10][cH:11]1

참가 물질

반응물 3

HCID 887Methanol

HCID 129927764-(6-Fluoronaphth-2-yl)piperidine

HCID 130640321-(Benzo[b]furan-4-yloxy)-2,3-epoxypropane

생성물 1

HCID 225958851-(1-Benzofuran-4-yloxy)-3-[4-(6-fluoronaphthalen-2-yl)piperidin-1-yl]propan-2-ol

출처 및 근거

ORD 기록: ord-c6ebba2aaa5148779e938af8d0d3d8e5
출처 데이터셋: Training data from https://doi.org/10.1039/C8SC04228D (6/10)
DOI: 10.1039/C8SC04228D

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