Ethanol → 4-(2-Amino-3-fluoro-butyryl)-piperazine-1-carboxylic acid propyl ester

반응식

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

참가 물질

반응물 3

HCID 702Ethanol

HCID 668548184-(2-Benzyloxycarbonylamino-3-fluoro-butyryl)-piperazine-1-carboxylic acid propyl ester

HCID 178418361HCID 178418361, 화합물

생성물 1

HCID 668545724-(2-Amino-3-fluoro-butyryl)-piperazine-1-carboxylic acid propyl ester

출처 및 근거

ORD 기록: ord-5b00f8f2a445427a8c07b0c648cdf692
출처 데이터셋: Training data from https://doi.org/10.1039/C8SC04228D (3/10)
DOI: 10.1039/C8SC04228D

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