Water → 1-(1,2-Benzoxazol-3-yl)ethan-1-one
반응식
[CH3:19][CH2:20][O:21][CH2:22][CH3:23].[OH2:18].[S:1](=[O:2])(=[O:3])([OH:4])[OH:5].[o:6]1[n:7][c:8]([CH:15]([CH3:16])[OH:17])[c:9]2[c:10]1[cH:11][cH:12][cH:13][cH:14]2>>[o:6]1[n:7][c:8]([C:15]([CH3:16])=[O:17])[c:9]2[c:10]1[cH:11][cH:12][cH:13][cH:14]2참가 물질
5
출처 및 근거
- ORD 기록
- ord-3d39b501ca764e2b9f9172f610de5c93
- 출처 데이터셋
- Training data from https://doi.org/10.1039/C8SC04228D (9/10)
반응 노트
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