Ethanol → HCID 10332347, 화합물
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[CH3:21][CH2:22][OH:23].[NH2:13][c:14]1[c:15]([CH3:20])[cH:16][cH:17][cH:18][cH:19]1.[NH2:1][c:2]1[n:3][c:4]2[cH:5][cH:6][cH:7][cH:8][c:9]2[c:10]([Cl:12])[n:11]1>>[NH2:1][c:2]1[n:3][c:4]2[cH:5][cH:6][cH:7][cH:8][c:9]2[c:10]([NH:13][c:14]2[c:15]([CH3:20])[cH:16][cH:17][cH:18][cH:19]2)[n:11]1참가 물질
4
출처 및 근거
- ORD 기록
- ord-e98a29cf33434b93a60ccef145e0e274
- 출처 데이터셋
- Training data from https://doi.org/10.1039/C8SC04228D (10/10)
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