Ethanol → HCID 22407461, compound
Reaction equation
[CH2:1]([CH2:2][CH2:3][CH3:4])[c:5]1[n:6][c:7]2[c:8]([n:9][c:10]([CH3:19])[c:11]([NH:13][C:14](=[O:15])[N:16]([CH3:17])[CH3:18])[cH:12]2)[n:20]1[CH2:21][c:22]1[cH:23][cH:24][c:25]([O:28][CH:29]([c:30]2[cH:31][cH:32][cH:33][cH:34][cH:35]2)[C:36](=[O:37])[O:38][CH2:39][CH3:40])[cH:26][cH:27]1.[CH3:43][CH2:44][OH:45].[Na+:42].[OH-:41]>>[CH2:1]([CH2:2][CH2:3][CH3:4])[c:5]1[n:6][c:7]2[c:8]([n:9][c:10]([CH3:19])[c:11]([NH:13][C:14](=[O:15])[N:16]([CH3:17])[CH3:18])[cH:12]2)[n:20]1[CH2:21][c:22]1[cH:23][cH:24][c:25]([O:28][CH:29]([c:30]2[cH:31][cH:32][cH:33][cH:34][cH:35]2)[C:36](=[O:37])[OH:38])[cH:26][cH:27]1Participants
5
Sources & evidence
- ORD record
- ord-b2ce7c41bcb24592b1ddcf1afee73759
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (4/10)
Reaction notes
Loading…