Methanol → HCID 178458770, 화합물
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[CH3:39][OH:40].[Cl:1][c:2]1[c:3]([C:9](=[O:10])[NH:11][CH:12]2[CH:13]([O:33][CH2:34][CH:35]=[CH2:36])[CH2:14][N:15]([c:18]3[s:19][c:20]([C:29](=[O:30])[O:31][CH3:32])[c:21](-[c:23]4[n:24][cH:25][n:26][n:27]4[CH3:28])[n:22]3)[CH2:16][CH2:17]2)[nH:4][c:5]([CH3:8])[c:6]1[Cl:7].[Na+:38].[OH-:37]>>[Cl:1][c:2]1[c:3]([C:9](=[O:10])[NH:11][CH:12]2[CH:13]([O:33][CH2:34][CH:35]=[CH2:36])[CH2:14][N:15]([c:18]3[s:19][c:20]([C:29](=[O:30])[OH:31])[c:21](-[c:23]4[n:24][cH:25][n:26][n:27]4[CH3:28])[n:22]3)[CH2:16][CH2:17]2)[nH:4][c:5]([CH3:8])[c:6]1[Cl:7]참가 물질
5
출처 및 근거
- ORD 기록
- ord-2f20fa67b1c7473881ef47937166c235
- 출처 데이터셋
- Training data from https://doi.org/10.1039/C8SC04228D (10/10)