Citric Acid → 4-Tert-butoxycarbonylamino-4-cyclohexyl-butyric acid
반응식
[CH3:1][O:2][C:3]([CH2:4][CH2:5][CH:6]([CH:7]1[CH2:8][CH2:9][CH2:10][CH2:11][CH2:12]1)[NH:13][C:14](=[O:15])[O:16][C:17]([CH3:18])([CH3:19])[CH3:20])=[O:21].[CH3:37][OH:38].[Na+:23].[OH-:22].[OH:24][C:25]([CH2:26][C:27]([C:28](=[O:29])[OH:30])([CH2:31][C:32](=[O:33])[OH:34])[OH:35])=[O:36]>>[O:2]=[C:3]([CH2:4][CH2:5][CH:6]([CH:7]1[CH2:8][CH2:9][CH2:10][CH2:11][CH2:12]1)[NH:13][C:14](=[O:15])[O:16][C:17]([CH3:18])([CH3:19])[CH3:20])[OH:21]참가 물질
6
출처 및 근거
- ORD 기록
- ord-afdf719080d0421ca8b6c386e8296dfa
- 출처 데이터셋
- Training data from https://doi.org/10.1039/C8SC04228D (8/10)
반응 노트
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