반응식
[C:1]12([c:11]3[cH:12][cH:13][c:14]([O:15][CH2:16][C:17](=[O:18])[OH:19])[cH:20][cH:21]3)[CH2:2][CH:3]3[CH2:4][CH:5]([CH2:6][CH:7]([CH2:8]1)[CH2:9]3)[CH2:10]2.[CH2:22]([CH3:23])[O:24][C:25]([c:26]1[cH:27][c:28]([NH2:32])[cH:29][cH:30][cH:31]1)=[O:33].[CH:44]([N:45]([CH2:46][CH3:47])[CH:48]([CH3:49])[CH3:50])([CH3:51])[CH3:52].[O:53]=[CH:54][N:55]([CH3:56])[CH3:57].[OH:34][n:35]1[c:36]2[cH:37][cH:38][cH:39][cH:40][c:41]2[n:42][n:43]1>>[C:1]12([c:11]3[cH:12][cH:13][c:14]([O:15][CH2:16][C:17](=[O:18])[NH:32][c:28]4[cH:27][c:26]([C:25]([O:24][CH2:22][CH3:23])=[O:33])[cH:31][cH:30][cH:29]4)[cH:20][cH:21]3)[CH2:2][CH:3]3[CH2:4][CH:5]([CH2:6][CH:7]([CH2:8]1)[CH2:9]3)[CH2:10]2참가 물질
6
출처 및 근거
- ORD 기록
- ord-71b8ff43a5eb473d8f0aaa7bfdf7eeb5
- 출처 데이터셋
- Training data from https://doi.org/10.1039/C8SC04228D (6/10)
연결된 노트
불러오는 중…