Ethanol → HCID 11734695, compound
Reaction equation
[CH2:1]([CH:2]([CH3:3])[CH3:4])[c:5]1[cH:6][cH:7][c:8]([CH:11]([c:12]2[cH:13][cH:14][c:15]([CH2:18][CH:19]([CH3:20])[CH3:21])[cH:16][cH:17]2)[NH:22][c:23]2[cH:24][c:25]([C:26](=[O:27])[c:28]3[cH:29][c:30]([CH2:37][CH2:38][CH2:39][C:40](=[O:41])[O:42][CH2:43][CH3:44])[n:31]4[cH:32][cH:33][cH:34][cH:35][c:36]34)[cH:45][cH:46][cH:47]2)[cH:9][cH:10]1.[CH3:50][CH2:51][OH:52].[Na+:49].[OH-:48]>>[CH2:1]([CH:2]([CH3:3])[CH3:4])[c:5]1[cH:6][cH:7][c:8]([CH:11]([c:12]2[cH:13][cH:14][c:15]([CH2:18][CH:19]([CH3:20])[CH3:21])[cH:16][cH:17]2)[NH:22][c:23]2[cH:24][c:25]([C:26](=[O:27])[c:28]3[cH:29][c:30]([CH2:37][CH2:38][CH2:39][C:40](=[O:41])[OH:42])[n:31]4[cH:32][cH:33][cH:34][cH:35][c:36]34)[cH:45][cH:46][cH:47]2)[cH:9][cH:10]1Participants
5
Sources & evidence
- ORD record
- ord-d95cf627e12044dea3f9ec6f2db77b6b
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (7/10)
Reaction notes
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