4-(oxiran-2-ylmethoxy)-1H-indole → 1-(1H-indol-4-yloxy)-3-[4-(6-nitro-1H-indol-3-yl)-3,6-dihydro-2H-pyridin-1-yl]propan-2-ol

반응식

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

참가 물질

반응물 2

HCID 6050154-(oxiran-2-ylmethoxy)-1H-indole

HCID 212682696-Nitro-3-(1,2,3,6-tetrahydro-4-pyridinyl)-1H-indole

생성물 1

HCID 212683401-(1H-indol-4-yloxy)-3-[4-(6-nitro-1H-indol-3-yl)-3,6-dihydro-2H-pyridin-1-yl]propan-2-ol

출처 및 근거

ORD 기록: ord-d7d52cc51e2f4ac3a5ce1dc848437576
출처 데이터셋: Training data from https://doi.org/10.1039/C8SC04228D (6/10)
DOI: 10.1039/C8SC04228D

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