반응식
[CH2:13]1[CH2:14][CH2:15][C:16]2=[N:21][CH2:20][CH2:19][CH2:18][N:17]2[CH2:22][CH2:23]1.[CH3:45][C:46]#[N:47].[ClH:1].[NH2:24][c:25]1[c:26]2[c:27](=[O:44])[c:28]([C:41](=[O:42])[OH:43])[cH:29][n:30]([CH:38]3[CH2:39][CH2:40]3)[c:31]2[c:32]([F:37])[c:33]([F:36])[c:34]1[F:35].[n:2]1([CH:7]2[CH2:8][CH2:9][NH:10][CH2:11][CH2:12]2)[n:3][n:4][cH:5][cH:6]1>>[n:2]1([CH:7]2[CH2:8][CH2:9][N:10]([c:33]3[c:32]([F:37])[c:31]4[c:26]([c:25]([NH2:24])[c:34]3[F:35])[c:27](=[O:44])[c:28]([C:41](=[O:42])[OH:43])[cH:29][n:30]4[CH:38]3[CH2:39][CH2:40]3)[CH2:11][CH2:12]2)[n:3][n:4][cH:5][cH:6]1참가 물질
6
반응물 5
생성물 1
출처 및 근거
- ORD 기록
- ord-d4c992fcbcff4650ab122c6af5e343e8
- 출처 데이터셋
- Training data from https://doi.org/10.1039/C8SC04228D (8/10)
연결된 노트
불러오는 중…