Ethanol → HCID 66778017, compound
Reaction equation
[CH3:46][CH2:47][OH:48].[CH:1]1([CH:7]([c:8]2[o:9][c:10]3[c:11]([c:12]2[CH3:13])[cH:14][c:15]([O:18][CH2:19][CH2:20][CH2:21][S:22](=[O:23])(=[O:24])[CH3:25])[cH:16][cH:17]3)[NH:26][c:27]2[cH:28][cH:29][c:30]([C:33](=[O:34])[N:35]([CH2:36][CH2:37][C:38](=[O:39])[O:40][CH2:41][CH3:42])[CH3:43])[cH:31][cH:32]2)[CH2:2][CH2:3][CH2:4][CH2:5][CH2:6]1.[Na+:45].[OH-:44]>>[CH:1]1([CH:7]([c:8]2[o:9][c:10]3[c:11]([c:12]2[CH3:13])[cH:14][c:15]([O:18][CH2:19][CH2:20][CH2:21][S:22](=[O:23])(=[O:24])[CH3:25])[cH:16][cH:17]3)[NH:26][c:27]2[cH:28][cH:29][c:30]([C:33](=[O:34])[N:35]([CH2:36][CH2:37][C:38](=[O:39])[OH:40])[CH3:43])[cH:31][cH:32]2)[CH2:2][CH2:3][CH2:4][CH2:5][CH2:6]1Participants
5
Sources & evidence
- ORD record
- ord-4a521e586dbd4139998c156159acd3c5
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (6/10)
Reaction notes
Loading…