Water → HCID 23130682, 화합물
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[Al+3:2].[H-:1].[H-:4].[H-:5].[H-:6].[Li+:3].[O:24]1[CH2:25][CH2:26][CH2:27][CH2:28]1.[OH2:23].[c:7]1([NH:13][CH2:14][c:15]2[cH:16][cH:17][c:18]([C:19]#[N:20])[cH:21][cH:22]2)[cH:8][cH:9][cH:10][cH:11][cH:12]1>>[c:7]1([NH:13][CH2:14][c:15]2[cH:16][cH:17][c:18]([CH2:19][NH2:20])[cH:21][cH:22]2)[cH:8][cH:9][cH:10][cH:11][cH:12]1참가 물질
7
출처 및 근거
- ORD 기록
- ord-a2fd500411c542d9a4c80c9ee75dede6
- 출처 데이터셋
- Training data from https://doi.org/10.1039/C8SC04228D (9/10)
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