Ammonium → 1-Phenyl-4-(5-methyl-2-thienyl)-1,4-butanedione
반응식
[CH3:13][N:14]([CH2:15][CH2:16][C:17](=[O:18])[c:19]1[s:20][c:21]([CH3:24])[cH:22][cH:23]1)[CH3:25].[CH3:28][N:29]([CH3:30])[CH:31]=[O:32].[CH:4](=[O:5])[c:6]1[cH:7][cH:8][cH:9][cH:10][cH:11]1.[ClH:12].[NH4+:26].[Na:1][C:2]#[N:3].[OH-:27].[OH2:33]>>[C:4](=[O:5])([c:6]1[cH:7][cH:8][cH:9][cH:10][cH:11]1)[CH2:15][CH2:16][C:17](=[O:18])[c:19]1[s:20][c:21]([CH3:24])[cH:22][cH:23]1참가 물질
9
출처 및 근거
- ORD 기록
- ord-06e568cf71864f869348fdbd43f3cd0b
- 출처 데이터셋
- Training data from https://doi.org/10.1039/C8SC04228D (8/10)
반응 노트
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