HCID 19380618, 화합물 → HCID 19380695, 화합물
반응식
[CH2:1]([CH2:2][CH2:3][CH2:4][CH2:5][CH2:6][CH2:7][CH2:8][CH2:9][CH2:10][CH2:11][CH3:12])[c:13]1[cH:14][n:15][c:16](-[c:19]2[cH:20][cH:21][c:22]([OH:25])[cH:23][cH:24]2)[n:17][cH:18]1.[CH3:26][S:27]([O:28][CH2:31][CH2:32][CH:33]([CH2:34][CH2:35][CH2:36][CH3:37])[F:38])(=[O:29])=[O:30]>>[CH2:1]([CH2:2][CH2:3][CH2:4][CH2:5][CH2:6][CH2:7][CH2:8][CH2:9][CH2:10][CH2:11][CH3:12])[c:13]1[cH:14][n:15][c:16](-[c:19]2[cH:20][cH:21][c:22]([O:25][CH2:31][CH2:32][CH:33]([CH2:34][CH2:35][CH2:36][CH3:37])[F:38])[cH:23][cH:24]2)[n:17][cH:18]1참가 물질
3
출처 및 근거
- ORD 기록
- ord-aee99555d9b34ba68f9b745892e5f528
- 출처 데이터셋
- Training data from https://doi.org/10.1039/C8SC04228D (7/10)
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