Acetic Acid → 5H-Dibenzo(a,d)cycloheptene-2-acetic acid, alpha-methyl-5-oxo-
반응식
[CH3:22][C:23]([OH:24])=[O:25].[ClH:26].[OH2:27].[cH:1]1[c:2]([CH:17]([C:18](=[O:19])[NH2:20])[CH3:21])[cH:3][cH:4][c:5]2[c:6](=[O:16])[c:7]3[c:8]([cH:9][cH:10][c:11]12)[cH:12][cH:13][cH:14][cH:15]3>>[cH:1]1[c:2]([CH:17]([C:18](=[O:19])[OH:24])[CH3:21])[cH:3][cH:4][c:5]2[c:6](=[O:16])[c:7]3[c:8]([cH:9][cH:10][c:11]12)[cH:12][cH:13][cH:14][cH:15]3참가 물질
5
출처 및 근거
- ORD 기록
- ord-207a8e64d8e947319508cd5bdc518c94
- 출처 데이터셋
- Training data from https://doi.org/10.1039/C8SC04228D (4/10)
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