Acetic Acid → HCID 19895670, 화합물
반응식
[CH3:1][C:2]1([CH3:19])[O:3][c:4]2[c:5]([cH:15][cH:16][cH:17][cH:18]2)[C:6]([c:8]2[n:9][cH:10][cH:11][cH:12][c:13]2[CH3:14])=[CH:7]1.[CH3:20][C:21](=[O:22])[OH:23].[CH3:24][CH2:25][OH:26]>>[CH3:1][C:2]1([CH3:19])[O:3][c:4]2[c:5]([cH:15][cH:16][cH:17][cH:18]2)[CH:6]([c:8]2[n:9][cH:10][cH:11][cH:12][c:13]2[CH3:14])[CH2:7]1참가 물질
4
출처 및 근거
- ORD 기록
- ord-18a53c98dc16447f9af7862d3c258019
- 출처 데이터셋
- Training data from https://doi.org/10.1039/C8SC04228D (8/10)
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