Acetic Acid → 4-[2-(4-Bromo-2-methyl-phenylamino)-ethyl]-tetrahydro-pyran-4-carboxylic acid methyl ester

HRID 116881

반응식

HRID 116881 반응식
[CH3:10][O:11][C:12](=[O:13])[C:14]1([CH2:20][CH:21]=[O:22])[CH2:15][CH2:16][O:17][CH2:18][CH2:19]1.[CH3:1][c:2]1[c:3]([NH2:4])[cH:5][cH:6][c:7]([Br:9])[cH:8]1.[CH3:23][C:24](=[O:25])[OH:26].[CH3:37][OH:38].[Cl:34][CH2:35][Cl:36].[NH2:27][c:28]1[cH:29][cH:30][cH:31][cH:32][cH:33]1>>[CH3:1][c:2]1[c:3]([NH:4][CH2:21][CH2:20][C:14]2([C:12]([O:11][CH3:10])=[O:13])[CH2:15][CH2:16][O:17][CH2:18][CH2:19]2)[cH:5][cH:6][c:7]([Br:9])[cH:8]1

참가 물질

7

출처 및 근거

ORD 기록
ord-46dbb03888e340ee8f05c22999297d11
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (2/10)

연결된 노트

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