HCID 69592846, 화합물 → HCID 86758262, 화합물
반응식
[C:1]([CH3:2])([CH3:3])([CH3:4])[O:5][C:6]([NH:7][c:8]1[cH:9][c:10]([O:22][C:23]([CH3:24])([CH3:25])[CH3:26])[c:11](-[c:15]2[c:16]([F:21])[cH:17][cH:18][cH:19][cH:20]2)[cH:12][c:13]1[NH2:14])=[O:27].[C:28]([CH3:30])([CH3:31])([O:32][C:33](=[O:29])[CH2:34][C:35](=[O:36])[c:37]1[s:38][c:39]([C:42]#[N:43])[cH:40][cH:41]1)[CH3:44]>>[C:1]([CH3:2])([CH3:3])([CH3:4])[O:5][C:6]([NH:7][c:8]1[cH:9][c:10]([O:22][C:23]([CH3:24])([CH3:25])[CH3:26])[c:11](-[c:15]2[c:16]([F:21])[cH:17][cH:18][cH:19][cH:20]2)[cH:12][c:13]1[NH:14][C:33](=[O:32])[CH2:34][C:35](=[O:36])[c:37]1[s:38][c:39]([C:42]#[N:43])[cH:40][cH:41]1)=[O:27]참가 물질
3
출처 및 근거
- ORD 기록
- ord-afcd5fb94b124868ac768a5b16c8b3b2
- 출처 데이터셋
- Training data from https://doi.org/10.1039/C8SC04228D (1/10)
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