Benzaldehyde → HCID 178435290, 화합물
반응식
[BH3:56].[CH2:1]([CH3:2])[O:3][C:4](=[O:5])[C:6]1([NH:11][C:12]([CH:13]2[N:14]([C:37](=[O:38])[NH:39][NH2:40])[CH2:15][CH:16]([O:18][c:19]3[cH:20][c:21](-[c:31]4[cH:32][cH:33][cH:34][cH:35][cH:36]4)[n:22][c:23]4[cH:24][c:25]([O:29][CH3:30])[cH:26][cH:27][c:28]34)[CH2:17]2)=[O:41])[CH:7]([CH:9]=[CH2:10])[CH2:8]1.[CH2:60]1[O:61][CH2:62][CH2:63][CH2:64]1.[CH3:58][OH:59].[CH:42](=[O:43])[c:44]1[cH:45][cH:46][cH:47][cH:48][cH:49]1.[ClH:57].[n:50]1[cH:51][cH:52][cH:53][cH:54][cH:55]1>>[CH2:1]([CH3:2])[O:3][C:4](=[O:5])[C:6]1([NH:11][C:12]([CH:13]2[N:14]([C:37](=[O:38])[NH:39][NH:40][CH2:42][c:44]3[cH:45][cH:46][cH:47][cH:48][cH:49]3)[CH2:15][CH:16]([O:18][c:19]3[cH:20][c:21](-[c:31]4[cH:32][cH:33][cH:34][cH:35][cH:36]4)[n:22][c:23]4[cH:24][c:25]([O:29][CH3:30])[cH:26][cH:27][c:28]34)[CH2:17]2)=[O:41])[CH:7]([CH:9]=[CH2:10])[CH2:8]1참가 물질
8
출처 및 근거
- ORD 기록
- ord-510d1d1037f34cb3a1e2c5abb842a786
- 출처 데이터셋
- Training data from https://doi.org/10.1039/C8SC04228D (6/10)
반응 노트
불러오는 중…