Ethanol → HCID 20566121, 화합물
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[C:1]([c:2]1[cH:3][cH:4][c:5]([O:8][CH3:9])[cH:6][cH:7]1)(=[O:10])[c:11]1[cH:12][cH:13][c:14]([CH2:17][C:18](=[O:19])[O:20][CH3:21])[n:15]1[CH3:16].[CH3:24][CH2:25][OH:26].[Na+:23].[OH-:22].[OH2:27]>>[C:1]([c:2]1[cH:3][cH:4][c:5]([O:8][CH3:9])[cH:6][cH:7]1)(=[O:10])[c:11]1[cH:12][cH:13][c:14]([CH2:17][C:18](=[O:19])[OH:20])[n:15]1[CH3:16]참가 물질
6
출처 및 근거
- ORD 기록
- ord-58c6ed3e455e4ecdaacf78536335acfd
- 출처 데이터셋
- Training data from https://doi.org/10.1039/C8SC04228D (2/10)
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