반응식
[CH2:38]([Cl:39])[Cl:40].[CH3:9][C:10]([CH2:11][CH3:12])([CH3:13])[CH:14]1[CH2:15][CH2:16][CH:17]([O:20][c:21]2[cH:22][c:23]3[cH:24][cH:25][c:26]([C:31]4([CH3:37])[NH:32][C:33](=[O:36])[O:34][CH2:35]4)[cH:27][c:28]3[cH:29][cH:30]2)[CH2:18][CH2:19]1.[Cl-:41].[Cl-:42].[Cl-:43].[Cl-:44].[I:1][N:2]1[C:3](=[O:4])[CH2:5][CH2:6][C:7]1=[O:8].[Zr+4:45]>>[I:1][c:22]1[c:21]([O:20][CH:17]2[CH2:16][CH2:15][CH:14]([C:10]([CH3:9])([CH2:11][CH3:12])[CH3:13])[CH2:19][CH2:18]2)[cH:30][cH:29][c:28]2[c:23]1[cH:24][cH:25][c:26]([C:31]1([CH3:37])[NH:32][C:33](=[O:36])[O:34][CH2:35]1)[cH:27]2참가 물질
6
출처 및 근거
- ORD 기록
- ord-ef3064fd8cd4481d82c14368713b721e
- 출처 데이터셋
- Training data from https://doi.org/10.1039/C8SC04228D (6/10)
연결된 노트
불러오는 중…