Ethanol → HCID 69034876, 화합물
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[CH3:20][CH2:21][OH:22].[NH2:1][c:2]1[cH:3][c:4]([C:13]([C:14]#[N:15])([CH3:16])[CH3:17])[n:5][n:6]1-[c:7]1[cH:8][cH:9][cH:10][cH:11][cH:12]1.[Na+:19].[OH-:18]>>[NH2:1][c:2]1[cH:3][c:4]([C:13]([C:14](=[O:18])[OH:22])([CH3:16])[CH3:17])[n:5][n:6]1-[c:7]1[cH:8][cH:9][cH:10][cH:11][cH:12]1참가 물질
5
출처 및 근거
- ORD 기록
- ord-21c29264ead14b25a57fda5348be4bfd
- 출처 데이터셋
- Training data from https://doi.org/10.1039/C8SC04228D (7/10)
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