Pyridine → Methyl 3-(4-{acetyl[(2',6'-dimethylbiphenyl-3-yl)methyl]amino}phenyl)propanoate

반응식

[CH3:1][c:2]1[c:3](-[c:9]2[cH:10][c:11]([CH2:15][NH:16][c:17]3[cH:18][cH:19][c:20]([CH2:23][CH2:24][C:25](=[O:26])[O:27][CH3:28])[cH:21][cH:22]3)[cH:12][cH:13][cH:14]2)[c:4]([CH3:8])[cH:5][cH:6][cH:7]1.[CH3:29][C:30](=[O:31])[O:32][C:33](=[O:34])[CH3:35].[cH:36]1[cH:37][cH:38][n:39][cH:40][cH:41]1>>[CH3:1][c:2]1[c:3](-[c:9]2[cH:10][c:11]([CH2:15][N:16]([c:17]3[cH:18][cH:19][c:20]([CH2:23][CH2:24][C:25](=[O:26])[O:27][CH3:28])[cH:21][cH:22]3)[C:30]([CH3:29])=[O:31])[cH:12][cH:13][cH:14]2)[c:4]([CH3:8])[cH:5][cH:6][cH:7]1

참가 물질

반응물 3

HCID 1049Pyridine

HCID 7918Acetic Anhydride

HCID 23157312Methyl 3-(4-{[(2',6'-dimethylbiphenyl-3-yl)methyl]amino}phenyl)propanoate

생성물 1

HCID 23157605Methyl 3-(4-{acetyl[(2',6'-dimethylbiphenyl-3-yl)methyl]amino}phenyl)propanoate

출처 및 근거

ORD 기록: ord-e57a9ea25e0a49f2b9ec983c1e3343a0
출처 데이터셋: Training data from https://doi.org/10.1039/C8SC04228D (2/10)
DOI: 10.1039/C8SC04228D

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