Ethanol → N'-(3,7-dimethylocta-2,6-dienyl)-N-(2-pyridin-2-ylethyl)oxamide

반응식

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

참가 물질

반응물 3

HCID 702Ethanol

HCID 759192-Pyridineethanamine

HCID 72265544Ethyl 2-(3,7-dimethylocta-2,6-dienylamino)-2-oxoacetate

생성물 1

HCID 71060548N'-(3,7-dimethylocta-2,6-dienyl)-N-(2-pyridin-2-ylethyl)oxamide

출처 및 근거

ORD 기록: ord-df158154f0aa448694756b5073f610b8
출처 데이터셋: Training data from https://doi.org/10.1039/C8SC04228D (4/10)
DOI: 10.1039/C8SC04228D

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