Diisobutylamine → 5-(2-Diisobutylamino-ethyl)-2-methyl-1H-indole-3-carboxylic Acid Benzyl Ester
반응식
[CH2:1]([c:2]1[cH:3][cH:4][cH:5][cH:6][cH:7]1)[O:8][C:9](=[O:10])[c:11]1[c:12]([CH3:27])[nH:13][c:14]2[cH:15][cH:16][c:17]([CH2:20][CH2:21][O:22][S:23]([CH3:24])(=[O:25])=[O:26])[cH:18][c:19]12.[CH2:28]([CH:29]([CH3:30])[CH3:31])[NH:32][CH2:33][CH:34]([CH3:35])[CH3:36].[O:37]1[CH2:38][CH2:39][O:40][CH2:41][CH2:42]1>>[CH2:1]([c:2]1[cH:3][cH:4][cH:5][cH:6][cH:7]1)[O:8][C:9](=[O:10])[c:11]1[c:12]([CH3:27])[nH:13][c:14]2[cH:15][cH:16][c:17]([CH2:20][CH2:21][N:32]([CH2:28][CH:29]([CH3:30])[CH3:31])[CH2:33][CH:34]([CH3:35])[CH3:36])[cH:18][c:19]12참가 물질
4
출처 및 근거
- ORD 기록
- ord-cd248dd658134625a33fe528dc59a3e0
- 출처 데이터셋
- Training data from https://doi.org/10.1039/C8SC04228D (6/10)
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