반응식
[CH3:25][C:26](=[O:27])[OH:28].[NH2:5][c:6]1[cH:7][cH:8][c:9]([N:12]2[CH2:13][CH2:14][N:15]([c:18]3[cH:19][cH:20][n:21][cH:22][cH:23]3)[CH2:16][CH2:17]2)[cH:10][cH:11]1.[Na:1][O:2][C:3]#[N:4].[OH2:24]>>[O:2]=[C:3]([NH2:4])[NH:5][c:6]1[cH:7][cH:8][c:9]([N:12]2[CH2:13][CH2:14][N:15]([c:18]3[cH:19][cH:20][n:21][cH:22][cH:23]3)[CH2:16][CH2:17]2)[cH:10][cH:11]1참가 물질
5
출처 및 근거
- ORD 기록
- ord-fe196ebf337046a99305f318fab6f190
- 출처 데이터셋
- Training data from https://doi.org/10.1039/C8SC04228D (6/10)
연결된 노트
불러오는 중…