Ethanol → HCID 14691048, 화합물
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[B:1]([O-:2])=[O:3].[CH3:25][CH2:26][OH:27].[CH3:5][C:6]1=[C:7]([CH2:14][C:15]([CH:16]=[O:17])([CH3:18])[CH3:19])[CH:8]([C:11](=[CH2:12])[CH3:13])[CH2:9][CH2:10]1.[Na+:4].[S:20](=[O:21])(=[O:22])([OH:23])[OH:24]>>[CH3:5][C:6]1=[C:7]([CH2:14][C:15]([CH2:16][OH:17])([CH3:18])[CH3:19])[CH:8]([C:11](=[CH2:12])[CH3:13])[CH2:9][CH2:10]1참가 물질
6
출처 및 근거
- ORD 기록
- ord-ed2c538afe9c4949a8b33041a44abf94
- 출처 데이터셋
- Training data from https://doi.org/10.1039/C8SC04228D (1/10)
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