Water → HCID 59770937, 화합물
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[Al+3:16].[CH3:1][N:2]([c:3]1[o:4][c:5]2[c:6]([n:7]1)[cH:8][c:9]([C:12]#[N:13])[cH:10][cH:11]2)[CH3:14].[H-:15].[H-:18].[H-:19].[H-:20].[Li+:17].[OH2:21]>>[CH3:1][N:2]([c:3]1[o:4][c:5]2[c:6]([n:7]1)[cH:8][c:9]([CH2:12][NH2:13])[cH:10][cH:11]2)[CH3:14]참가 물질
6
출처 및 근거
- ORD 기록
- ord-f4390023afc14b7b96574f2df9f78725
- 출처 데이터셋
- Training data from https://doi.org/10.1039/C8SC04228D (8/10)
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