4,4-Dimethylpent-1-yn-3-ol → 1-{4-[1-Ethyl-1-(4-methoxyphenyl)-propyl]-2-methylphenyl}-4,4-dimethylpent-1-YN-3-OL
반응식
[CH2:9]([CH3:10])[C:11]([CH2:12][CH3:13])([c:14]1[cH:15][cH:16][c:17]([O:20][CH3:21])[cH:18][cH:19]1)[c:22]1[cH:23][c:24]([CH3:29])[c:25]([OH:28])[cH:26][cH:27]1.[CH3:1][C:2]([CH:3]([C:4]#[CH:5])[OH:6])([CH3:7])[CH3:8]>>[CH3:1][C:2]([CH:3]([C:4]#[C:5][c:25]1[c:24]([CH3:29])[cH:23][c:22]([C:11]([CH2:9][CH3:10])([CH2:12][CH3:13])[c:14]2[cH:15][cH:16][c:17]([O:20][CH3:21])[cH:18][cH:19]2)[cH:27][cH:26]1)[OH:6])([CH3:7])[CH3:8]참가 물질
3
출처 및 근거
- ORD 기록
- ord-4627ceb2b5a948d9ae007c65d60a3440
- 출처 데이터셋
- Training data from https://doi.org/10.1039/C8SC04228D (9/10)
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