Ethanol → HCID 13336364, compound
Reaction equation
[CH2:1]([CH3:2])[N:3]([C:4](=[O:5])[c:6]1[cH:7][c:8](-[c:16]2[cH:17][cH:18][cH:19][cH:20][cH:21]2)[n:9][c:10]2[cH:11][cH:12][cH:13][cH:14][c:15]12)[CH2:22][CH2:23][CH2:24][CH:25]1[CH2:26][CH2:27][N:28]([CH2:31][c:32]2[cH:33][cH:34][cH:35][cH:36][cH:37]2)[CH2:29][CH2:30]1.[CH2:49]([NH:50][CH2:51][CH3:52])[CH3:53].[CH3:61][c:62]1[cH:63][cH:64][cH:65][cH:66][cH:67]1.[CH3:68][CH2:69][OH:70].[Cl:38][C:39]([O:40][CH2:41][C:42]([Cl:43])([Cl:44])[Cl:45])=[O:46].[K+:48].[OH-:47].[c:54]1([CH3:55])[cH:56][cH:57][cH:58][cH:59][cH:60]1>>[CH2:1]([CH3:2])[N:3]([C:4](=[O:5])[c:6]1[cH:7][c:8](-[c:16]2[cH:17][cH:18][cH:19][cH:20][cH:21]2)[n:9][c:10]2[cH:11][cH:12][cH:13][cH:14][c:15]12)[CH2:22][CH2:23][CH2:24][CH:25]1[CH2:26][CH2:27][NH:28][CH2:29][CH2:30]1Participants
8
Sources & evidence
- ORD record
- ord-2f57f0ce3fd6451291959220f7ac66ee
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (4/10)
Reaction notes
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