Methanol → HCID 22721094, compound
Reaction equation
[CH3:45][OH:46].[CH:40]1([CH2:41][OH:42])[CH2:43][O:44]1.[Cl:1][c:2]1[cH:3][cH:4][c:5]([CH:8]2[N:9]=[C:10]([c:28]3[c:29]([O:36][CH:37]([CH3:38])[CH3:39])[cH:30][c:31]([O:34][CH3:35])[cH:32][cH:33]3)[N:11]([C:20](=[O:21])[N:22]3[CH2:23][CH2:24][NH:25][CH2:26][CH2:27]3)[CH:12]2[c:13]2[cH:14][cH:15][c:16]([Cl:19])[cH:17][cH:18]2)[cH:6][cH:7]1>>[Cl:1][c:2]1[cH:3][cH:4][c:5]([CH:8]2[N:9]=[C:10]([c:28]3[c:29]([O:36][CH:37]([CH3:38])[CH3:39])[cH:30][c:31]([O:34][CH3:35])[cH:32][cH:33]3)[N:11]([C:20](=[O:21])[N:22]3[CH2:23][CH2:24][N:25]([CH2:43][CH:40]([CH2:41][OH:42])[OH:44])[CH2:26][CH2:27]3)[CH:12]2[c:13]2[cH:14][cH:15][c:16]([Cl:19])[cH:17][cH:18]2)[cH:6][cH:7]1Participants
4
Sources & evidence
- ORD record
- ord-a9aada33eee248a0b4c47fccbc92b24b
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (3/10)
Reaction notes
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