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[F:1][c:2]1[c:3]([OH:31])[cH:4][c:5]([CH2:26][C:27]([F:28])([F:29])[F:30])[c:6](-[c:8]2[cH:9][cH:10][c:11]3[c:12](-[c:17]4[nH:18][c:19]5[c:20]([n:25]4)[CH2:21][NH:22][CH2:23][CH2:24]5)[n:13][nH:14][c:15]3[cH:16]2)[cH:7]1.[n:32]1[cH:33][cH:34][cH:35][c:36]2[cH:37][c:38]([CH:42]=[O:43])[cH:39][cH:40][c:41]12>>[F:1][c:2]1[c:3]([OH:31])[cH:4][c:5]([CH2:26][C:27]([F:28])([F:29])[F:30])[c:6](-[c:8]2[cH:9][cH:10][c:11]3[c:12](-[c:17]4[nH:18][c:19]5[c:20]([n:25]4)[CH2:21][N:22]([CH2:42][c:38]4[cH:37][c:36]6[cH:35][cH:34][cH:33][n:32][c:41]6[cH:40][cH:39]4)[CH2:23][CH2:24]5)[n:13][nH:14][c:15]3[cH:16]2)[cH:7]1참가 물질
3
출처 및 근거
- ORD 기록
- ord-d4bc07e7724641f5b26dc92700649b5d
- 출처 데이터셋
- Training data from https://doi.org/10.1039/C8SC04228D (6/10)
연결된 노트
불러오는 중…