Ethanol → HCID 20407005, 화합물
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[CH3:21][CH2:22][OH:23].[Cl:1][CH2:2][CH2:3][CH:4]([C:5](=[O:6])[NH:7][c:8]1[cH:9][c:10]([C:13]([CH3:14])([CH3:15])[CH3:16])[n:11][o:12]1)[CH3:17].[K+:19].[OH-:18].[OH2:20]>>[CH2:2]1[CH2:3][CH:4]([CH3:17])[C:5](=[O:6])[N:7]1[c:8]1[cH:9][c:10]([C:13]([CH3:14])([CH3:15])[CH3:16])[n:11][o:12]1참가 물질
6
출처 및 근거
- ORD 기록
- ord-b04da9a078cd45049e8437562fd74824
- 출처 데이터셋
- Training data from https://doi.org/10.1039/C8SC04228D (3/10)
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