Ethanol → HCID 58828971, compound
Reaction equation
[BH4-:1].[CH2:2]([CH2:3][CH2:4][CH2:5][CH2:6][CH2:7][CH3:8])[c:9]1[n:10]([CH3:15])[c:11]([SH:14])[n:12][n:13]1.[CH2:41]([OH:42])[CH3:43].[I:16][c:17]1[cH:18][c:19]([O:37][CH2:38][CH2:39][CH3:40])[c:20]([CH2:21][NH:22][c:23]2[cH:24][cH:25][c:26]([CH2:29][C:30](=[O:31])[O:32][CH2:33][CH3:34])[cH:27][cH:28]2)[cH:35][cH:36]1.[O:44]1[CH2:45][CH2:46][CH2:47][CH2:48]1>>[CH2:2]([CH2:3][CH2:4][CH2:5][CH2:6][CH2:7][CH3:8])[c:9]1[n:10]([CH3:15])[c:11]([S:14][c:17]2[cH:18][c:19]([O:37][CH2:38][CH2:39][CH3:40])[c:20]([CH2:21][NH:22][c:23]3[cH:24][cH:25][c:26]([CH2:29][C:30](=[O:31])[O:32][CH2:33][CH3:34])[cH:27][cH:28]3)[cH:35][cH:36]2)[n:12][n:13]1Participants
6
Sources & evidence
- ORD record
- ord-4f692c5dbf6d46019d318e814c58f6ec
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (2/10)
Reaction notes
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