Ethanol → HCID 54055976, compound
Reaction equation
[C:1]([CH3:2])([CH3:3])([CH3:4])[O:5][C:6]([CH:7]=[C:8]([CH2:9][CH2:10][CH2:11][CH2:12][CH2:13][CH2:14][c:15]1[n:16][c:17]2[c:22]([cH:23][cH:24]1)[CH2:21][CH2:20][CH2:19][NH:18]2)[c:25]1[cH:26][c:27]2[c:28]([s:29]1)[cH:30][cH:31][cH:32][cH:33]2)=[O:34].[CH3:35][OH:36].[CH3:37][CH2:38][OH:39]>>[C:1]([CH3:2])([CH3:3])([CH3:4])[O:5][C:6]([CH2:7][CH:8]([CH2:9][CH2:10][CH2:11][CH2:12][CH2:13][CH2:14][c:15]1[n:16][c:17]2[c:22]([cH:23][cH:24]1)[CH2:21][CH2:20][CH2:19][NH:18]2)[c:25]1[cH:26][c:27]2[c:28]([s:29]1)[cH:30][cH:31][cH:32][cH:33]2)=[O:34]Participants
4
Sources & evidence
- ORD record
- ord-0045f2d3e101459ebf36bd6b897ebfba
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (8/10)
Reaction notes
Loading…