Ethanol → HCID 59216388, compound
Reaction equation
[CH2:54]([O:55][C:56](=[O:57])[CH3:58])[CH3:59].[CH3:51][CH2:52][OH:53].[NH2:1][c:2]1[cH:3][c:4](-[c:10]2[c:11]([CH2:30][OH:31])[c:12]([N:16]3[C:17](=[O:29])[c:18]4[cH:19][cH:20][c:21]([N:26]([CH3:27])[CH3:28])[cH:22][c:23]4[CH2:24][CH2:25]3)[cH:13][cH:14][cH:15]2)[cH:5][n:6]([CH3:9])[c:7]1=[O:8].[O:32]=[C:33]1[CH2:34][CH2:35][C:36](=[O:37])[N:38]1[O:39][C:40]([CH2:41][C:42]#[N:43])=[O:44].[O:45]1[CH2:46][CH2:47][O:48][CH2:49][CH2:50]1>>[NH:1]([c:2]1[cH:3][c:4](-[c:10]2[c:11]([CH2:30][OH:31])[c:12]([N:16]3[C:17](=[O:29])[c:18]4[cH:19][cH:20][c:21]([N:26]([CH3:27])[CH3:28])[cH:22][c:23]4[CH2:24][CH2:25]3)[cH:13][cH:14][cH:15]2)[cH:5][n:6]([CH3:9])[c:7]1=[O:8])[C:40](=[O:39])[CH2:41][C:42]#[N:43]Participants
6
Sources & evidence
- ORD record
- ord-32f0a223004c495ebc5eda291578b969
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (7/10)
Reaction notes
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