Methanol → HCID 178440159, compound
Reaction equation
[CH3:50][OH:51].[CH:30]([CH3:31])([CH3:32])[c:33]1[s:34][cH:35][c:36]([CH2:38][O:39][C:40](=[O:41])[NH:42][CH:43]([CH:44]([CH3:45])[CH3:46])[C:47](=[O:48])[OH:49])[n:37]1.[Cl:52][CH2:53][Cl:54].[NH2:1][CH:2]([CH2:3][CH:4]([CH:5]([CH2:6][c:7]1[cH:8][cH:9][cH:10][cH:11][cH:12]1)[NH:13][C:14](=[O:15])[O:16][CH2:17][c:18]1[cH:19][n:20][cH:21][s:22]1)[OH:23])[CH2:24][c:25]1[cH:26][n:27][cH:28][s:29]1>>[NH:1]([CH:2]([CH2:3][CH:4]([CH:5]([CH2:6][c:7]1[cH:8][cH:9][cH:10][cH:11][cH:12]1)[NH:13][C:14](=[O:15])[O:16][CH2:17][c:18]1[cH:19][n:20][cH:21][s:22]1)[OH:23])[CH2:24][c:25]1[cH:26][n:27][cH:28][s:29]1)[C:47]([CH:43]([NH:42][C:40]([O:39][CH2:38][c:36]1[cH:35][s:34][c:33]([CH:30]([CH3:31])[CH3:32])[n:37]1)=[O:41])[CH:44]([CH3:45])[CH3:46])=[O:48]Participants
5
Sources & evidence
- ORD record
- ord-532b92c849414f83abc799a3dad49214
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (9/10)
Reaction notes
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