Calcium Cation → Ethanone, 1-(4-amino-3-iodophenyl)-
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[C:1](=[O:2])([O-:3])[O-:4].[C:6]([CH3:7])(=[O:8])[c:9]1[cH:10][cH:11][c:12]([NH2:13])[cH:14][cH:15]1.[CH3:19][OH:20].[CH3:21][CH2:22][O:23][CH2:24][CH3:25].[Ca+2:5].[I:16][Cl:17].[OH2:18]>>[C:6]([CH3:7])(=[O:8])[c:9]1[cH:10][c:11]([I:16])[c:12]([NH2:13])[cH:14][cH:15]1참가 물질
8
출처 및 근거
- ORD 기록
- ord-a9bf1e72d38d42bf9e2a5b208b282825
- 출처 데이터셋
- Training data from https://doi.org/10.1039/C8SC04228D (5/10)
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