Ethanol → HCID 73087639, compound
Reaction equation
[CH2:1]([c:2]1[cH:3][cH:4][cH:5][cH:6][cH:7]1)[CH:8]([CH:9]([CH2:10][NH:11][CH:12]([CH3:13])[C:14]([NH:15][CH:16]1[CH2:17][CH2:18][CH2:19][CH2:20][CH2:21]1)=[O:22])[OH:23])[NH:24][C:25]([c:26]1[cH:27][c:28]([N+:38]([O-:39])=[O:40])[cH:29][c:30]([N:32]2[C:33](=[O:37])[CH2:34][CH2:35][CH2:36]2)[cH:31]1)=[O:41].[CH3:42][CH2:43][OH:44].[OH2:45]>>[CH2:1]([c:2]1[cH:3][cH:4][cH:5][cH:6][cH:7]1)[CH:8]([CH:9]([CH2:10][NH:11][CH:12]([CH3:13])[C:14]([NH:15][CH:16]1[CH2:17][CH2:18][CH2:19][CH2:20][CH2:21]1)=[O:22])[OH:23])[NH:24][C:25]([c:26]1[cH:27][c:28]([NH2:38])[cH:29][c:30]([N:32]2[C:33](=[O:37])[CH2:34][CH2:35][CH2:36]2)[cH:31]1)=[O:41]Participants
4
Sources & evidence
- ORD record
- ord-ed1da06f37344be3b22dc0090d4b80bf
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (8/10)
Reaction notes
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