Acetic Acid → 5-Oxo-4-(4-oxobutyl)-[1,4]diazepane-1-carboxylic acid tert-butyl ester
반응식
[C:1]([CH3:2])([CH3:3])([CH3:4])[O:5][C:6](=[O:7])[N:8]1[CH2:9][CH2:10][N:11]([CH2:16][CH2:17][CH2:18][CH:19]([O:20][CH3:23])[O:21][CH3:22])[C:12](=[O:15])[CH2:13][CH2:14]1.[CH3:24][C:25](=[O:26])[OH:27]>>[C:1]([CH3:2])([CH3:3])([CH3:4])[O:5][C:6](=[O:7])[N:8]1[CH2:9][CH2:10][N:11]([CH2:16][CH2:17][CH2:18][CH:19]=[O:20])[C:12](=[O:15])[CH2:13][CH2:14]1참가 물질
3
출처 및 근거
- ORD 기록
- ord-68497284e4814821aca47073ce5931e5
- 출처 데이터셋
- Training data from https://doi.org/10.1039/C8SC04228D (3/10)
반응 노트
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