Sodium Ion → 3-Cyano-8-hydroxydibenzo[b,f]thiepine
반응식
[N:24]([O-:25])=[O:26].[NH2:1][c:2]1[cH:3][cH:4][c:5]2[c:6]([cH:18]1)[CH:7]=[CH:8][c:9]1[c:10]([cH:12][c:13]([C:16]#[N:17])[cH:14][cH:15]1)[S:11]2.[Na+:27].[OH2:28].[S:19]([OH:20])(=[O:21])(=[O:22])[OH:23]>>[c:2]1([OH:20])[cH:3][cH:4][c:5]2[c:6]([cH:18]1)[CH:7]=[CH:8][c:9]1[c:10]([cH:12][c:13]([C:16]#[N:17])[cH:14][cH:15]1)[S:11]2참가 물질
6
출처 및 근거
- ORD 기록
- ord-0d164edb950a458aa198af70259e1bae
- 출처 데이터셋
- Training data from https://doi.org/10.1039/C8SC04228D (3/10)
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