Methanol → HCID 59725991, compound
Reaction equation
[C:1]([CH3:2])([CH3:3])([CH3:4])[O:5][C:6](=[O:7])[N:8]([c:9]1[c:10]2[n:11][cH:12][n:13](-[c:18]3[cH:19][cH:20][c:21]([NH:24][C:25]([NH:26][c:27]4[cH:28][c:29]([C:30](=[O:31])[OH:32])[cH:33][c:34]([C:36]([F:37])([F:38])[F:39])[cH:35]4)=[O:40])[cH:22][cH:23]3)[c:14]2[n:15][cH:16][n:17]1)[CH3:41].[CH3:48][OH:49].[Cl:42][C:43]([C:44]([Cl:45])=[O:46])=[O:47].[Cl:56][CH2:57][Cl:58].[NH2:50][CH:51]([CH2:52][OH:53])[CH2:54][OH:55]>>[C:1]([CH3:2])([CH3:3])([CH3:4])[O:5][C:6](=[O:7])[N:8]([c:9]1[c:10]2[n:11][cH:12][n:13](-[c:18]3[cH:19][cH:20][c:21]([NH:24][C:25]([NH:26][c:27]4[cH:28][c:29]([C:30](=[O:32])[NH:50][CH:51]([CH2:52][OH:53])[CH2:54][OH:55])[cH:33][c:34]([C:36]([F:37])([F:38])[F:39])[cH:35]4)=[O:40])[cH:22][cH:23]3)[c:14]2[n:15][cH:16][n:17]1)[CH3:41]Participants
6
Sources & evidence
- ORD record
- ord-c6e0fa69653448cab4cf4cba0024e31b
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (5/10)
Reaction notes
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