Acetic Acid → 2-Methyl-7-nitro-1,2,3,4-tetrahydroisoquinoline
반응식
[C:21]([BH3-:22])#[N:23].[CH3:17][C:18](=[O:19])[OH:20].[Cl:25][CH:26]([Cl:27])[CH3:28].[ClH:14].[N+:1](=[O:2])([O-:3])[c:4]1[cH:5][cH:6][c:7]2[c:12]([cH:13]1)[CH2:11][NH:10][CH2:9][CH2:8]2.[Na+:16].[Na+:24].[OH-:15]>>[N+:1](=[O:2])([O-:3])[c:4]1[cH:5][cH:6][c:7]2[c:12]([cH:13]1)[CH2:11][N:10]([CH3:17])[CH2:9][CH2:8]2참가 물질
8
출처 및 근거
- ORD 기록
- ord-83c0d75d6e144ce9803311a3dadd1bc9
- 출처 데이터셋
- Training data from https://doi.org/10.1039/C8SC04228D (1/10)
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