Methanol → 2-Butenedioic acid
반응식
[C:27]([CH:28]=[CH:29][C:30](=[O:31])[O-:32])(=[O:33])[O-:34].[CH3:1][N:2]1[CH2:3][CH:4]2[CH2:5][N:6]([CH3:12])[CH2:7][CH:8]([CH2:9]1)[CH:10]2[OH:11].[CH3:35][OH:36].[CH:13]([c:14]1[cH:15][cH:16][cH:17][cH:18][cH:19]1)([c:20]1[cH:21][cH:22][cH:23][cH:24][cH:25]1)[Br:26]>>[C:27]([CH:28]=[CH:29][C:30](=[O:31])[OH:32])(=[O:33])[OH:34].[CH3:1][N:2]1[CH2:3][CH:4]2[CH2:5][N:6]([CH3:12])[CH2:7][CH:8]([CH2:9]1)[CH:10]2[O:11][CH:13]([c:14]1[cH:15][cH:16][cH:17][cH:18][cH:19]1)[c:20]1[cH:21][cH:22][cH:23][cH:24][cH:25]1참가 물질
6
출처 및 근거
- ORD 기록
- ord-a4ad6338db21410da2520384f7c4bd13
- 출처 데이터셋
- Training data from https://doi.org/10.1039/C8SC04228D (1/10)
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