Ethanol → HCID 69232462, compound
Reaction equation
[C:1]([CH3:2])([CH3:3])([CH3:4])[O:5][C:6]([CH2:7][CH2:8][c:9]1[c:10]([CH2:31][NH:32][C:33](=[O:34])[O:35][CH:36]([CH3:37])[CH3:38])[cH:11][c:12]([O:15][CH2:16][CH2:17][c:18]2[n:19][c:20](-[c:24]3[cH:25][cH:26][c:27]([OH:30])[cH:28][cH:29]3)[o:21][c:22]2[CH3:23])[cH:13][cH:14]1)=[O:39].[CH3:50][CH2:51][OH:52].[I:40][CH:41]([CH3:42])[CH3:43].[K+:44].[K+:45].[O-:46][C:47]([O-:48])=[O:49]>>[C:1]([CH3:2])([CH3:3])([CH3:4])[O:5][C:6]([CH2:7][CH2:8][c:9]1[c:10]([CH2:31][NH:32][C:33](=[O:34])[O:35][CH:36]([CH3:37])[CH3:38])[cH:11][c:12]([O:15][CH2:16][CH2:17][c:18]2[n:19][c:20](-[c:24]3[cH:25][cH:26][c:27]([O:30][CH:41]([CH3:42])[CH3:43])[cH:28][cH:29]3)[o:21][c:22]2[CH3:23])[cH:13][cH:14]1)=[O:39]Participants
6
Sources & evidence
- ORD record
- ord-493d75d059c640d3aecb89fafc3a9120
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (3/10)
Reaction notes
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