Water → 3,3-Dimethyl-4-[2-(4-nitro-phenyl)-6-oxo-4-thioxo-6H-1-oxa-3b,5-diaza-cyclopenta[a]pentalen-5-yl]-butyric acid
반응식
[CH2:1]([CH3:2])[O:3][C:4]([CH2:5][C:6]([CH2:7][N:8]1[C:9](=[O:29])[c:10]2[n:11]([c:12]3[cH:13][c:14](-[c:18]4[cH:19][cH:20][c:21]([N+:24](=[O:25])[O-:26])[cH:22][cH:23]4)[o:15][c:16]3[cH:17]2)[C:27]1=[S:28])([CH3:30])[CH3:31])=[O:32].[OH2:33].[OH:34][C:35]([C:36]([F:37])([F:38])[F:39])=[O:40]>>[O:3]=[C:4]([CH2:5][C:6]([CH2:7][N:8]1[C:9](=[O:29])[c:10]2[n:11]([c:12]3[cH:13][c:14](-[c:18]4[cH:19][cH:20][c:21]([N+:24](=[O:25])[O-:26])[cH:22][cH:23]4)[o:15][c:16]3[cH:17]2)[C:27]1=[S:28])([CH3:30])[CH3:31])[OH:32]참가 물질
4
반응물 3
생성물 1
출처 및 근거
- ORD 기록
- ord-e7706d7201df44bf9bef5ef6e5be0bb4
- 출처 데이터셋
- Training data from https://doi.org/10.1039/C8SC04228D (1/10)
반응 노트
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