Calcium Cation → 6-[[(1-Propylimidazol-2-yl)methyl]sulfanyl]pyridine-3-amine
반응식
[CH3:23][CH2:24][OH:25].[Ca+2:22].[Cl-:20].[Cl-:21].[Fe:26].[N+:1]([O-:2])(=[O:3])[c:4]1[cH:5][cH:6][c:7]([S:10][CH2:11][c:12]2[n:13]([CH2:17][CH2:18][CH3:19])[cH:14][cH:15][n:16]2)[n:8][cH:9]1>>[NH2:1][c:4]1[cH:5][cH:6][c:7]([S:10][CH2:11][c:12]2[n:13]([CH2:17][CH2:18][CH3:19])[cH:14][cH:15][n:16]2)[n:8][cH:9]1참가 물질
6
출처 및 근거
- ORD 기록
- ord-84628c3e528f469999f70905ea0db404
- 출처 데이터셋
- Training data from https://doi.org/10.1039/C8SC04228D (4/10)
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