1-Methylindole-3-carboxylic acid → HCID 178480533, 화합물

반응식

[CH3:24][n:25]1[cH:26][c:27]([C:34](=[O:35])[OH:36])[c:28]2[cH:29][cH:30][cH:31][cH:32][c:33]12.[NH2:1][c:2]1[s:3][c:4](-[c:17]2[cH:18][c:19]([F:23])[cH:20][cH:21][cH:22]2)[c:5]([C:7](=[O:8])[N:9]2[CH:10]3[CH2:11][CH:12]3[CH2:13][CH:14]2[CH2:15][NH2:16])[n:6]1>>[NH2:1][c:2]1[s:3][c:4](-[c:17]2[cH:18][c:19]([F:23])[cH:20][cH:21][cH:22]2)[c:5]([C:7](=[O:8])[N:9]2[CH:10]3[CH2:11][CH:12]3[CH2:13][CH:14]2[CH2:15][NH:16][C:34]([c:27]2[cH:26][n:25]([CH3:24])[c:33]3[c:28]2[cH:29][cH:30][cH:31][cH:32]3)=[O:35])[n:6]1

참가 물질

반응물 2

HCID 8540401-Methylindole-3-carboxylic acid

HCID 178509363HCID 178509363, 화합물

생성물 1

HCID 178480533HCID 178480533, 화합물

출처 및 근거

ORD 기록: ord-3ef54f5f2629425883f7169ff29dbf11
출처 데이터셋: Training data from https://doi.org/10.1039/C8SC04228D (2/10)
DOI: 10.1039/C8SC04228D

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