Acetic Acid → Methyl {4-[({4-[(4-butylphenyl)ethynyl]benzyl}amino)methyl]phenoxy}acetate
반응식
[CH2:19]([CH2:20][CH2:21][CH3:22])[c:23]1[cH:24][cH:25][c:26]([C:29]#[C:30][c:31]2[cH:32][cH:33][c:34]([CH:35]=[O:36])[cH:37][cH:38]2)[cH:27][cH:28]1.[CH3:15][C:16](=[O:17])[OH:18].[NH2:1][CH2:2][c:3]1[cH:4][cH:5][c:6]([O:7][CH2:8][C:9](=[O:10])[O:11][CH3:12])[cH:13][cH:14]1>>[NH:1]([CH2:2][c:3]1[cH:4][cH:5][c:6]([O:7][CH2:8][C:9](=[O:10])[O:11][CH3:12])[cH:13][cH:14]1)[CH2:35][c:34]1[cH:33][cH:32][c:31]([C:30]#[C:29][c:26]2[cH:25][cH:24][c:23]([CH2:19][CH2:20][CH2:21][CH3:22])[cH:28][cH:27]2)[cH:38][cH:37]1참가 물질
4
출처 및 근거
- ORD 기록
- ord-69c69cab73f143a9937b9fb728037ee8
- 출처 데이터셋
- Test data from https://doi.org/10.1039/C8SC04228D
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