Ethanol → HCID 59565505, compound
Reaction equation
[CH3:32][CH2:33][OH:34].[CH3:35][OH:36].[CH:1]1([CH2:4][O:5][CH:6]2[CH2:7][CH2:8][CH:9]([N:12]3[CH2:13][CH2:14][CH:15]([NH:18][c:19]4[c:20]([N+:26]([O-:27])=[O:28])[cH:21][cH:22][c:23]([CH3:25])[cH:24]4)[CH2:16][CH2:17]3)[CH2:10][CH2:11]2)[CH2:2][CH2:3]1.[NH2:30][NH2:31].[OH2:29]>>[CH:1]1([CH2:4][O:5][CH:6]2[CH2:7][CH2:8][CH:9]([N:12]3[CH2:13][CH2:14][CH:15]([NH:18][c:19]4[c:20]([NH2:26])[cH:21][cH:22][c:23]([CH3:25])[cH:24]4)[CH2:16][CH2:17]3)[CH2:10][CH2:11]2)[CH2:2][CH2:3]1Participants
6
Sources & evidence
- ORD record
- ord-a6c889f7f1c84742bb10d1fc2b7137c5
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (8/10)
Reaction notes
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