Hydrochloric Acid → [2-Hydroxy-3-methyl-1-(3-oxo-propylcarbamoyl)-butyl]-carbamic acid benzyl ester
반응식
[C:31](=[O:32])([OH:33])[O-:34].[CH2:1]([c:2]1[cH:3][cH:4][cH:5][cH:6][cH:7]1)[O:8][C:9]([NH:10][CH:11]([CH:12]([CH:13]([CH3:14])[CH3:15])[OH:16])[C:17]([NH:18][CH2:19][CH2:20][CH:21]([O:22][CH2:26][CH3:27])[O:23][CH2:24][CH3:25])=[O:28])=[O:29].[ClH:30].[Na+:35].[O:36]1[CH2:37][CH2:38][CH2:39][CH2:40]1>>[CH2:1]([c:2]1[cH:3][cH:4][cH:5][cH:6][cH:7]1)[O:8][C:9]([NH:10][CH:11]([CH:12]([CH:13]([CH3:14])[CH3:15])[OH:16])[C:17]([NH:18][CH2:19][CH2:20][CH:21]=[O:22])=[O:28])=[O:29]참가 물질
6
출처 및 근거
- ORD 기록
- ord-519067758d4f4dce8a455aa63d503c86
- 출처 데이터셋
- Training data from https://doi.org/10.1039/C8SC04228D (4/10)
반응 노트
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