Ethylene Glycol → HCID 14547485, 화합물
반응식
[C:1]([CH3:2])(=[O:3])[c:4]1[cH:5][cH:6][c:7]2[c:8]([s:9][cH:10][cH:11]2)[cH:12]1.[CH3:29][c:30]1[cH:31][cH:32][cH:33][cH:34][cH:35]1.[OH2:28].[OH:24][CH2:25][CH2:26][OH:27].[c:13]1([CH3:14])[cH:15][cH:16][c:17]([S:18]([OH:19])(=[O:20])=[O:21])[cH:22][cH:23]1>>[C:1]1([CH3:2])([c:4]2[cH:5][cH:6][c:7]3[c:8]([s:9][cH:10][cH:11]3)[cH:12]2)[O:3][CH2:26][CH2:25][O:24]1참가 물질
6
출처 및 근거
- ORD 기록
- ord-2a744f21d81e42e6973e5f39f9b52c37
- 출처 데이터셋
- Training data from https://doi.org/10.1039/C8SC04228D (6/10)
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