tert-butyl 2-(tert-butylcarbamoyl)-4-oxopyrrolidine-1-carboxylate → benzyl N-[4-amino-1-[[4-[2-(tert-butylcarbamoyl)-4-oxopyrrolidin-1-yl]-3-hydroxy-4-oxo-1-phenylbutan-2-yl]amino]-1,4-dioxobutan-2-yl]carbamate

반응식

[C:33]([O:34][C:35](=[O:36])[N:40]1[CH:41]([C:42](=[O:43])[NH:44][C:45]([CH3:46])([CH3:47])[CH3:48])[CH2:49][C:50](=[O:52])[CH2:51]1)([CH3:37])([CH3:38])[CH3:39].[CH2:1]([c:2]1[cH:3][cH:4][cH:5][cH:6][cH:7]1)[O:8][C:9](=[O:10])[NH:11][CH:12]([CH2:13][C:14]([NH2:15])=[O:16])[C:17](=[O:18])[NH:19][CH:20]([CH:21]([C:22](=[O:23])[OH:24])[OH:25])[CH2:26][c:27]1[cH:28][cH:29][cH:30][cH:31][cH:32]1>>[CH2:1]([c:2]1[cH:3][cH:4][cH:5][cH:6][cH:7]1)[O:8][C:9](=[O:10])[NH:11][CH:12]([CH2:13][C:14]([NH2:15])=[O:16])[C:17](=[O:18])[NH:19][CH:20]([CH:21]([C:22](=[O:24])[N:40]1[CH:41]([C:42](=[O:43])[NH:44][C:45]([CH3:46])([CH3:47])[CH3:48])[CH2:49][C:50](=[O:52])[CH2:51]1)[OH:25])[CH2:26][c:27]1[cH:28][cH:29][cH:30][cH:31][cH:32]1

참가 물질

반응물 2

HCID 178449374tert-butyl 2-(tert-butylcarbamoyl)-4-oxopyrrolidine-1-carboxylate

HCID 178513934HCID 178513934, 화합물

생성물 1

HCID 20978850benzyl N-[4-amino-1-[[4-[2-(tert-butylcarbamoyl)-4-oxopyrrolidin-1-yl]-3-hydroxy-4-oxo-1-phenylbutan-2-yl]amino]-1,4-dioxobutan-2-yl]carbamate

출처 및 근거

ORD 기록: ord-ea16fc3b741d4848bd0d302d7a9d006a
출처 데이터셋: Training data from https://doi.org/10.1039/C8SC04228D (10/10)
DOI: 10.1039/C8SC04228D

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