Ethanol → HCID 66778040, compound
Reaction equation
[CH3:44][CH2:45][OH:46].[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][CH3:23])[cH:16][cH:17]3)[NH:24][c:25]2[cH:26][cH:27][c:28]([C:31](=[O:32])[N:33]([CH2:34][CH2:35][C:36](=[O:37])[O:38][CH2:39][CH3:40])[CH3:41])[cH:29][cH:30]2)[CH2:2][CH2:3][CH2:4][CH2:5][CH2:6]1.[Na+:43].[OH-:42]>>[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][CH3:23])[cH:16][cH:17]3)[NH:24][c:25]2[cH:26][cH:27][c:28]([C:31](=[O:32])[N:33]([CH2:34][CH2:35][C:36](=[O:37])[OH:38])[CH3:41])[cH:29][cH:30]2)[CH2:2][CH2:3][CH2:4][CH2:5][CH2:6]1Participants
5
Sources & evidence
- ORD record
- ord-453c3742ad7d4ffea9967e81afbda26e
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (7/10)
Reaction notes
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