반응식
[C:12]([c:13]1[cH:14][cH:15][cH:16][cH:17][cH:18]1)(=[O:19])[NH:20][C:21]([NH:22][CH:23]1[CH2:24][CH2:25][NH:26][CH2:27][CH2:28]1)=[O:29].[CH3:30][CH2:31][N:32]([CH2:33][CH3:34])[CH2:35][CH3:36].[CH3:38][N:39]([CH3:40])[CH:41]=[O:42].[CH:1]([CH3:2])([CH3:3])[c:4]1[cH:5][cH:6][c:7]([CH2:8][Cl:9])[cH:10][cH:11]1.[OH2:37]>>[CH:1]([CH3:2])([CH3:3])[c:4]1[cH:5][cH:6][c:7]([CH2:8][N:26]2[CH2:25][CH2:24][CH:23]([NH:22][C:21]([NH:20][C:12]([c:13]3[cH:14][cH:15][cH:16][cH:17][cH:18]3)=[O:19])=[O:29])[CH2:28][CH2:27]2)[cH:10][cH:11]1참가 물질
6
출처 및 근거
- ORD 기록
- ord-e5fb486aae204da297f4fea992aacab5
- 출처 데이터셋
- Training data from https://doi.org/10.1039/C8SC04228D (2/10)
연결된 노트
불러오는 중…