Ethanol → HCID 10143308, compound
Reaction equation
[CH3:42][CH2:43][OH:44].[OH:1][C:2]1([c:30]2[cH:31][cH:32][c:33](-[c:36]3[cH:37][cH:38][cH:39][cH:40][cH:41]3)[cH:34][cH:35]2)[C:3]([CH3:28])([CH3:29])[O:4][c:5]2[c:6]1[c:7]([CH3:27])[c:8]([N:13]1[CH2:14][CH2:15][N:16]([c:19]3[cH:20][cH:21][c:22]([O:25][CH3:26])[cH:23][cH:24]3)[CH2:17][CH2:18]1)[c:9]([CH3:12])[c:10]2[CH3:11]>>[CH:2]1([c:30]2[cH:31][cH:32][c:33](-[c:36]3[cH:37][cH:38][cH:39][cH:40][cH:41]3)[cH:34][cH:35]2)[C:3]([CH3:28])([CH3:29])[O:4][c:5]2[c:6]1[c:7]([CH3:27])[c:8]([N:13]1[CH2:14][CH2:15][N:16]([c:19]3[cH:20][cH:21][c:22]([O:25][CH3:26])[cH:23][cH:24]3)[CH2:17][CH2:18]1)[c:9]([CH3:12])[c:10]2[CH3:11]Participants
3
Sources & evidence
- ORD record
- ord-18c674fb6c7e4912aa2d9001c41d5fca
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (7/10)
Reaction notes
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