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[Br:1][c:2]1[cH:3][c:4]([C:8]#[C:9][Si:10]([CH3:11])([CH3:12])[CH3:13])[cH:5][cH:6][cH:7]1.[CH3:30][O:31][CH2:32][CH2:33][O:34][CH3:35].[F:14][c:15]1[n:16][cH:17][cH:18][cH:19][c:20]1[B:21]([OH:22])[OH:23].[Na+:24].[Na+:25].[O-:26][C:27](=[O:28])[O-:29].[OH2:36].[cH:37]1[cH:38][cH:39][c:40]([P:41]([Pd:42]([P:43]([c:44]2[cH:45][cH:46][cH:47][cH:48][cH:49]2)([c:50]2[cH:51][cH:52][cH:53][cH:54][cH:55]2)[c:56]2[cH:57][cH:58][cH:59][cH:60][cH:61]2)([P:62]([c:63]2[cH:64][cH:65][cH:66][cH:67][cH:68]2)([c:69]2[cH:70][cH:71][cH:72][cH:73][cH:74]2)[c:75]2[cH:76][cH:77][cH:78][cH:79][cH:80]2)[P:81]([c:82]2[cH:83][cH:84][cH:85][cH:86][cH:87]2)([c:88]2[cH:89][cH:90][cH:91][cH:92][cH:93]2)[c:94]2[cH:95][cH:96][cH:97][cH:98][cH:99]2)([c:100]2[cH:101][cH:102][cH:103][cH:104][cH:105]2)[c:106]2[cH:107][cH:108][cH:109][cH:110][cH:111]2)[cH:112][cH:113]1>>[c:2]1(-[c:20]2[c:15]([F:14])[n:16][cH:17][cH:18][cH:19]2)[cH:3][c:4]([C:8]#[C:9][Si:10]([CH3:11])([CH3:12])[CH3:13])[cH:5][cH:6][cH:7]1참가 물질
8
출처 및 근거
- ORD 기록
- ord-793d56de1dc34a4aa4ca5ab02aa2d3a7
- 출처 데이터셋
- Training data from https://doi.org/10.1039/C8SC04228D (8/10)
연결된 노트
불러오는 중…