Propanedioic acid, monoethyl ester → HCID 18682354, 화합물
반응식
[C:1]([CH3:2])([CH3:3])([CH3:4])[O:5][C:6](=[O:7])[NH:8][CH:9]([CH2:10][CH:11]([CH3:12])[CH3:13])[c:14]1[n:15][o:16][c:17]([C:19](=[O:20])[OH:21])[cH:18]1.[C:22]([c:23]1[nH:24][cH:25][cH:26][n:27]1)([c:28]1[nH:29][cH:30][cH:31][n:32]1)=[O:33].[C:35]([CH2:36][C:37]([O-:38])=[O:39])(=[O:40])[O:41][CH2:42][CH3:43].[Mg:34]>>[C:1]([CH3:2])([CH3:3])([CH3:4])[O:5][C:6](=[O:7])[NH:8][CH:9]([CH2:10][CH:11]([CH3:12])[CH3:13])[c:14]1[n:15][o:16][c:17]([C:19](=[O:21])[CH2:36][C:35](=[O:40])[O:41][CH2:42][CH3:43])[cH:18]1참가 물질
5
출처 및 근거
- ORD 기록
- ord-980031702a37459d8205e41bad60df3a
- 출처 데이터셋
- Training data from https://doi.org/10.1039/C8SC04228D (7/10)
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