Ethanol → 5,7-dimethoxy-3-{2-[4-(2-methoxyphenyl)-1-piperazinyl]ethyl}-4-methyl-2H-1-benzopyran-2-one
반응식
[CH3:1][S:2]([O:3][CH2:6][CH2:7][c:8]1[c:9](=[O:23])[o:10][c:11]2[c:12]([c:13]1[CH3:14])[c:15]([O:21][CH3:22])[cH:16][c:17]([O:19][CH3:20])[cH:18]2)(=[O:4])=[O:5].[CH3:24][O:25][c:26]1[c:27]([N:32]2[CH2:33][CH2:34][NH:35][CH2:36][CH2:37]2)[cH:28][cH:29][cH:30][cH:31]1.[CH3:38][CH2:39][OH:40]>>[CH2:6]([CH2:7][c:8]1[c:9](=[O:23])[o:10][c:11]2[c:12]([c:13]1[CH3:14])[c:15]([O:21][CH3:22])[cH:16][c:17]([O:19][CH3:20])[cH:18]2)[N:35]1[CH2:34][CH2:33][N:32]([c:27]2[c:26]([O:25][CH3:24])[cH:31][cH:30][cH:29][cH:28]2)[CH2:37][CH2:36]1참가 물질
4
출처 및 근거
- ORD 기록
- ord-9446319c5f954abbbac2c29cd7b2fc3c
- 출처 데이터셋
- Training data from https://doi.org/10.1039/C8SC04228D (8/10)
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