Ethanol → HCID 14882640, compound
Reaction equation
[CH2:1]([CH:2]=[CH2:3])[n:4]1[cH:5][c:6]([CH2:21][c:22]2[c:23]([O:41][CH3:42])[cH:24][c:25]([C:26](=[O:27])[NH:28][S:29](=[O:30])(=[O:31])[c:32]3[c:33]([CH3:38])[cH:34][cH:35][cH:36][cH:37]3)[cH:39][cH:40]2)[c:7]2[cH:8][c:9]([CH2:13][C:14]([NH:15][CH2:16][CH2:17][CH2:18][CH3:19])=[O:20])[cH:10][cH:11][c:12]12.[CH3:45][CH2:46][OH:47].[Na+:44].[OH-:43]>>[CH2:1]([CH2:2][CH3:3])[n:4]1[cH:5][c:6]([CH2:21][c:22]2[c:23]([O:41][CH3:42])[cH:24][c:25]([C:26](=[O:27])[NH:28][S:29](=[O:30])(=[O:31])[c:32]3[c:33]([CH3:38])[cH:34][cH:35][cH:36][cH:37]3)[cH:39][cH:40]2)[c:7]2[cH:8][c:9]([CH2:13][C:14]([NH:15][CH2:16][CH2:17][CH2:18][CH3:19])=[O:20])[cH:10][cH:11][c:12]12Participants
5
Sources & evidence
- ORD record
- ord-5db1d518e5f044e399dc4c490b6d9b5c
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (3/10)
Reaction notes
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