Methanol → HCID 58155399, compound
Reaction equation
[CH3:1][O:2][C:3]([CH2:4][N:5]([CH2:6][CH:7]1[CH2:8][CH2:9]1)[CH2:10][CH2:11][c:12]1[cH:13][c:14]([O:27][CH3:28])[c:15]([O:18][CH2:19][c:20]2[cH:21][c:22]([F:26])[cH:23][cH:24][cH:25]2)[cH:16][cH:17]1)=[O:29].[CH3:30][CH2:31][NH2:32].[CH3:33][Al:34]([CH3:35])[CH3:36].[CH3:37][OH:38].[CH3:39][c:40]1[cH:41][cH:42][cH:43][cH:44][cH:45]1.[CH3:51][CH2:52][CH2:53][CH2:54][CH2:55][CH2:56][CH3:57].[O:46]1[CH2:47][CH2:48][CH2:49][CH2:50]1>>[O:2]=[C:3]([CH2:4][N:5]([CH2:6][CH:7]1[CH2:8][CH2:9]1)[CH2:10][CH2:11][c:12]1[cH:13][c:14]([O:27][CH3:28])[c:15]([O:18][CH2:19][c:20]2[cH:21][c:22]([F:26])[cH:23][cH:24][cH:25]2)[cH:16][cH:17]1)[NH:32][CH2:31][CH3:30]Participants
8
Sources & evidence
- ORD record
- ord-71080c9e437b408c9b0b71d759bd87f9
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (3/10)
Reaction notes
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