Ethanol → HCID 22407568, compound
Reaction equation
[CH2:1]([CH2:2][CH2:3][CH3:4])[c:5]1[n:6][c:7]2[c:8]([n:9]1[CH2:10][c:11]1[cH:12][cH:13][c:14]([O:17][CH:18]([c:19]3[cH:20][cH:21][cH:22][cH:23][cH:24]3)[C:25](=[O:26])[O:27][CH2:28][CH3:29])[cH:15][cH:16]1)[cH:30][c:31]([NH:35][C:36](=[O:37])[C:38]([CH3:39])([CH3:40])[CH3:41])[cH:32][c:33]2[CH3:34].[CH3:44][CH2:45][OH:46].[Na+:43].[OH-:42]>>[CH2:1]([CH2:2][CH2:3][CH3:4])[c:5]1[n:6][c:7]2[c:8]([n:9]1[CH2:10][c:11]1[cH:12][cH:13][c:14]([O:17][CH:18]([c:19]3[cH:20][cH:21][cH:22][cH:23][cH:24]3)[C:25](=[O:26])[OH:27])[cH:15][cH:16]1)[cH:30][c:31]([NH:35][C:36](=[O:37])[C:38]([CH3:39])([CH3:40])[CH3:41])[cH:32][c:33]2[CH3:34]Participants
5
Sources & evidence
- ORD record
- ord-842d4d2b5f1f44a0ab90c7c320a27169
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (10/10)
Reaction notes
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