Methanol → HCID 178491904, 화합물
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[CH3:27][OH:28].[Cl:18][CH2:19][c:20]1[n+:21]([O-:26])[cH:22][cH:23][cH:24][cH:25]1.[Cl:1][c:2]1[c:3]([N:11]=[C:12]2[N:13]([OH:17])[CH2:14][CH2:15][NH:16]2)[c:4]([Cl:10])[cH:5][c:6]([O:8][CH3:9])[cH:7]1>>[Cl:1][c:2]1[c:3]([N:11]=[C:12]2[N:13]([O:17][CH2:19][c:20]3[n+:21]([O-:26])[cH:22][cH:23][cH:24][cH:25]3)[CH2:14][CH2:15][NH:16]2)[c:4]([Cl:10])[cH:5][c:6]([O:8][CH3:9])[cH:7]1참가 물질
4
출처 및 근거
- ORD 기록
- ord-df12509825394ae8874291f2f49e4538
- 출처 데이터셋
- Training data from https://doi.org/10.1039/C8SC04228D (1/10)
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