1-Butanol → HCID 178495565, 화합물
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[Br:1][c:2]1[c:3]([F:18])[c:4]2[c:5]([n:6][cH:7]1)[nH:8][cH:9][c:10]2[NH:11][C:12]([CH:13]([CH3:14])[O:15][CH3:16])=[O:17].[CH2:41]([OH:42])[CH2:43][CH2:44][CH3:45].[CH:32]([N:33]([CH2:34][CH3:35])[CH:36]([CH3:37])[CH3:38])([CH3:39])[CH3:40].[NH:19]1[CH2:20][CH:21]([NH:24][C:25]([O:26][C:27]([CH3:28])([CH3:29])[CH3:30])=[O:31])[CH2:22][CH2:23]1>>[Br:1][c:2]1[c:3]([N:19]2[CH2:20][CH:21]([NH:24][C:25]([O:26][C:27]([CH3:28])([CH3:29])[CH3:30])=[O:31])[CH2:22][CH2:23]2)[c:4]2[c:5]([n:6][cH:7]1)[nH:8][cH:9][c:10]2[NH:11][C:12]([CH:13]([CH3:14])[O:15][CH3:16])=[O:17]참가 물질
5
출처 및 근거
- ORD 기록
- ord-ff1ea67189af4f4fa73010a1a694aff1
- 출처 데이터셋
- Training data from https://doi.org/10.1039/C8SC04228D (10/10)