Phenylethanolamine → N-(2-hydroxy-2-phenylethyl)pent-4-ynamide
반응식
[C:1]([CH2:2][CH2:3][C:4]#[CH:5])(=[O:6])[Cl:7].[CH3:18][CH2:19][N:20]([CH2:21][CH3:22])[CH2:23][CH3:24].[Cl:25][CH2:26][Cl:27].[NH2:8][CH2:9][CH:10]([OH:11])[c:12]1[cH:13][cH:14][cH:15][cH:16][cH:17]1>>[C:1]([CH2:2][CH2:3][C:4]#[CH:5])(=[O:6])[NH:8][CH2:9][CH:10]([OH:11])[c:12]1[cH:13][cH:14][cH:15][cH:16][cH:17]1참가 물질
5
출처 및 근거
- ORD 기록
- ord-1ad231b63dee444bbf82f427a1fad0e2
- 출처 데이터셋
- Training data from https://doi.org/10.1039/C8SC04228D (8/10)
반응 노트
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