Methanol → HCID 178454462, compound
Reaction equation
[CH3:51][OH:52].[Cl:1][c:2]1[cH:3][cH:4][c:5]([N:8]([CH:9]2[CH2:10][CH:11]([CH3:37])[N:12]([C:19](=[O:20])[c:21]3[cH:22][cH:23][c:24]([O:25][CH2:26][CH2:27][C:28]([C:29](=[O:30])[O:31][CH3:32])([CH3:33])[CH3:34])[cH:35][cH:36]3)[c:13]3[cH:14][cH:15][cH:16][cH:17][c:18]32)[C:38]([CH:39]([CH3:40])[CH3:41])=[O:42])[cH:6][cH:7]1.[Na+:44].[O:46]1[CH2:47][CH2:48][CH2:49][CH2:50]1.[OH-:43].[OH2:45]>>[Cl:1][c:2]1[cH:3][cH:4][c:5]([N:8]([CH:9]2[CH2:10][CH:11]([CH3:37])[N:12]([C:19](=[O:20])[c:21]3[cH:22][cH:23][c:24]([O:25][CH2:26][CH2:27][C:28]([C:29](=[O:30])[OH:31])([CH3:33])[CH3:34])[cH:35][cH:36]3)[c:13]3[cH:14][cH:15][cH:16][cH:17][c:18]32)[C:38]([CH:39]([CH3:40])[CH3:41])=[O:42])[cH:6][cH:7]1Participants
7
Sources & evidence
- ORD record
- ord-48038eae9e2a4c0ea48153b89fbdfc34
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (8/10)
Reaction notes
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