Hydrogen Peroxide → 6-[4-(4-Acetamido-phenylsulfinyl)-butoxy]-4,4,7-trimethyl-4H-3,1-benzoxazin-2-one
반응식
[C:1]([CH3:2])(=[O:3])[NH:4][c:5]1[cH:6][cH:7][c:8]([S:11][CH2:12][CH2:13][CH2:14][CH2:15][O:16][c:17]2[c:18]([CH3:30])[cH:19][c:20]3[c:21]([cH:29]2)[C:22]([CH3:27])([CH3:28])[O:23][C:24](=[O:26])[NH:25]3)[cH:9][cH:10]1.[OH:31][OH:32]>>[C:1]([CH3:2])(=[O:3])[NH:4][c:5]1[cH:6][cH:7][c:8]([S:11]([CH2:12][CH2:13][CH2:14][CH2:15][O:16][c:17]2[c:18]([CH3:30])[cH:19][c:20]3[c:21]([cH:29]2)[C:22]([CH3:27])([CH3:28])[O:23][C:24](=[O:26])[NH:25]3)=[O:31])[cH:9][cH:10]1참가 물질
3
출처 및 근거
- ORD 기록
- ord-3d9b6c3896894f74bd017bc763bd52c3
- 출처 데이터셋
- Training data from https://doi.org/10.1039/C8SC04228D (2/10)
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