Methanol → HCID 68690722, compound
Reaction equation
[Br:1][c:2]1[n:3][cH:4][c:5]([O:32][CH3:33])[c:6]2[c:7]1[nH:8][cH:9][c:10]2[C:11]([C:12](=[O:13])[N:14]1[CH2:15][CH2:16][N:17]([c:20]2[n:21][n:22][n:23][n:24]2-[c:25]2[n:26][cH:27][cH:28][cH:29][cH:30]2)[CH2:18][CH2:19]1)=[O:31].[C:46](=[O:47])([O-:48])[O-:49].[CH3:59][OH:60].[Cl:43][CH2:44][Cl:45].[Cs+:50].[Cs+:51].[O:52]1[CH2:53][CH2:54][O:55][CH2:56][CH2:57]1.[OH2:58].[n:34]1[cH:35][n:36][cH:37][c:38]([B:40]([OH:41])[OH:42])[cH:39]1>>[c:2]1(-[c:38]2[cH:37][n:36][cH:35][n:34][cH:39]2)[n:3][cH:4][c:5]([O:32][CH3:33])[c:6]2[c:7]1[nH:8][cH:9][c:10]2[C:11]([C:12](=[O:13])[N:14]1[CH2:15][CH2:16][N:17]([c:20]2[n:21][n:22][n:23][n:24]2-[c:25]2[n:26][cH:27][cH:28][cH:29][cH:30]2)[CH2:18][CH2:19]1)=[O:31]Participants
9
Sources & evidence
- ORD record
- ord-02143fbf733943e7aca82e0b2bd3db78
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (9/10)
Reaction notes
Loading…