반응식
[C:1]([CH3:2])([CH3:3])([CH3:4])[c:5]1[cH:6][c:7]([CH2:8][Cl:9])[cH:10][c:11]([C:14]([CH3:15])([CH3:16])[CH3:17])[c:12]1[OH:13].[CH3:24][C:25](=[O:26])[CH3:27].[cH:18]1[cH:19][cH:20][n:21][cH:22][cH:23]1>>[C:1]([CH3:2])([CH3:3])([CH3:4])[c:5]1[cH:6][c:7]([CH2:8][n+:21]2[cH:20][cH:19][cH:18][cH:23][cH:22]2)[cH:10][c:11]([C:14]([CH3:15])([CH3:16])[CH3:17])[c:12]1[OH:13].[Cl-:9]참가 물질
5
출처 및 근거
- ORD 기록
- ord-2f68a0eac4be408491b5b393d2bb020f
- 출처 데이터셋
- Training data from https://doi.org/10.1039/C8SC04228D (5/10)
연결된 노트
불러오는 중…