반응식
[CH3:1][O:2][c:3]1[cH:4][c:5]2[c:22]([cH:23][cH:24]1)[CH:9]1[CH:8]([CH2:7][CH2:6]2)[CH:16]2[C:12]([CH3:21])([CH2:11][CH2:10]1)[C:13]1([CH2:14][CH2:15]2)[O:17][CH2:18][CH2:19][O:20]1.[CH3:25][O:26][c:27]1[cH:28][cH:29][c:30]2[c:40]([cH:41]1)[CH2:39][CH2:38][CH:37]1[CH:31]2[CH2:32][CH2:33][C:34]2([CH3:35])[CH:36]1[CH2:42][CH2:43][C:44]2=[O:45]>>[CH3:1][O:2][c:3]1[cH:4][c:5]2[c:22]([cH:23][cH:24]1)[C:9]1=[CH:10][CH2:11][C:12]3([CH3:21])[C:13]4([CH2:14][CH2:15][CH:16]3[CH:8]1[CH2:7][CH2:6]2)[O:17][CH2:18][CH2:19][O:20]4참가 물질
3
출처 및 근거
- ORD 기록
- ord-3b13b3d331cb4b249bd4b77b56f78490
- 출처 데이터셋
- Training data from https://doi.org/10.1039/C8SC04228D (3/10)
연결된 노트
불러오는 중…