Methanol → HCID 68695164, 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:53](=[O:54])([O-:55])[O-:56].[CH3:34][c:35]1[n:36][o:37][c:38]([CH3:49])[c:39]1[B:40]1[O:41][C:42]([CH3:43])([CH3:44])[C:45]([CH3:46])([CH3:47])[O:48]1.[CH3:66][OH:67].[Cl:50][CH2:51][Cl:52].[Cs+:57].[Cs+:58].[O:59]1[CH2:60][CH2:61][O:62][CH2:63][CH2:64]1.[OH2:65]>>[c:2]1(-[c:39]2[c:35]([CH3:34])[n:36][o:37][c:38]2[CH3:49])[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-4d42ce37db9041c4bdf75b6b5cacd60b
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (10/10)
Reaction notes
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